4'-Iodoacetophenone supplier | CasNO.13329-40-3

Name
4'-Iodoacetophenone
EINECS 236-372-8
CAS No. 13329-40-3
Article Data85
CAS DataBase
Density 1.72 g/cm³
Solubility solubile in methanol
Melting Point 82-84 °C(lit.)
Formula C₈H₇IO
Boiling Point 279.9 °C at 760 mmHg
Molecular Weight 246.047
Flash Point 123.1 °C
Transport Information
Appearance brown crystalline powder
Safety 26-37/39-24/25
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Acetophenone,4'-iodo- (6CI,7CI,8CI);Acetophenone, p-iodo- (3CI);1-(4-Iodophenyl)-1-ethanone;1-(4-Iodophenyl)ethanone;1-Acetyl-4-iodobenzene;1-Iodo-4-acetylbenzene;4-Acetyl-1-iodobenzene;4-Acetylphenyl iodide;4-Iodoacetophenone;4-Iodophenyl methyl ketone;4'-Iodoacetophenone;Methyl4-iodophenyl ketone;NSC 97396;p-Acetylphenyl iodide;p-Iodoacetophenone;p-Iodophenyl methyl ketone;
PSA 17.07000
LogP 2.49380

Synthetic route

: 68120-56-9, 104013-25-4, 53207-29-7
1-(4-iodophenyl)ethanol

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With silica-supported Jones reagent In dichloromethane for 0.00269444h;	99.6%
With 1,10-Phenanthroline; iron(III)-acetylacetonate; potassium carbonate In toluene for 48h; Reflux; Green chemistry;	94%
With [bis({2‐[bis(propan‐2‐yl)phosphanyl]ethyl})amine](borohydride)(carbonyl)(hydride)iron(II) In toluene at 120℃; for 12h; Glovebox; Schlenk technique; Inert atmosphere;	94%

: 766-99-4
1-ethynyl-4-iodobenzene

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With tetrakis(p-sulfonatophenyl)porphyrin cobalt(III) trisodium salt hexahydrate; water; bis(trifluoromethanesulfonyl)amide In methanol at 80℃; for 12h; Sealed tube;	97%

: 99-92-3
4-Aminoacetophenone

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
Stage #1: p-aminobenzophenone With hydrogenchloride In water at 0 - 5℃; for 0.166667h; Stage #2: With 1-methyl-3-(2-[2-(1-methyl-1H-imidazol-3-ium-3-yl)ethyloxy]ethyl)-1H-imidazol-3-ium dinitrite In water for 0.166667h; Stage #3: With potassium iodide In water at 20℃; for 0.166667h; Ionic liquid;	95%
With toluene-4-sulfonic acid; sodium iodide In water; acetonitrile at 10 - 20℃; for 2h; Inert atmosphere;	94%
With N-iodo-succinimide; sodium nitrite In N,N-dimethyl-formamide at 20℃; for 4h; Reagent/catalyst; Temperature; Solvent;	92%

: 86452-55-3
1-(p-acetophenyl)-3,3-diethyl-1-triazene

A: 13329-40-3
4-Iodoacetophenone

B: 71-43-2
benzene

Conditions

Conditions	Yield
With sulfonic acid resin (H+ form, Bio-Rad AG 50W-12); sodium iodide In acetonitrile at 75℃; for 0.133333h;	A 95% B n/a

: 85972-28-7
1-(3,4-Diiodocyclohexa-1,3-dienyl)ethanone

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene	95%

: 22021-09-6
1,2,2-triphenyl-1-iodoethylene

: 4,5-dimethoxy-2-(trimethylsilyl)phenyl trifluoromethanesulfonate

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With thallium(I) acetate; cesium fluoride; bis(dibenzylideneacetone)-palladium(0) In toluene; acetonitrile at 90℃; for 8h;	95%

: 109613-00-5
4-acetophenyl triflate

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With [Cp*Ru(CH3CN)3]OTf; sodium iodide at 120℃; for 12h; Inert atmosphere;	95%
With iodine; lithium fluoride; sodium iodide In acetonitrile at 25℃; for 24h; Inert atmosphere; UV-irradiation; Schlenk technique;	20%
Multi-step reaction with 2 steps 1: KOAc / PdCl2(dppf) / dimethylsulfoxide / 3 h / 80 °C 2: 30 percent / aq. NaI; chloramine-T / tetrahydrofuran / 6 h View Scheme

: 86452-55-3
1-(p-acetophenyl)-3,3-diethyl-1-triazene

A: 13329-40-3
4-Iodoacetophenone

B: 98-86-2
acetophenone

Conditions

Conditions	Yield
With cation exchange resin BioRad AG 50W-X12 (H+); sodium iodide In acetonitrile at 75℃; Product distribution; further solvent: THF, DMSO;	A 94% B 6%

: 99-90-1
para-bromoacetophenone

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With copper(I) oxide; L-proline; potassium iodide In ethanol at 110℃; for 30h; Schlenk technique; Inert atmosphere; Sealed tube;	92%
With tributylphosphine; potassium iodide; nickel dibromide In N,N,N,N,N,N-hexamethylphosphoric triamide; N,N-dimethyl-formamide at 50℃; for 1.5h;	66%
With N,N,N,N,N,N-hexamethylphosphoric triamide; copper(l) iodide; potassium iodide at 150 - 160℃; for 5h;	60%

: 86452-55-3
1-(p-acetophenyl)-3,3-diethyl-1-triazene

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With chloro-trimethyl-silane; sodium iodide In acetonitrile at 60℃; for 0.0833333h;	92%

: 149104-90-5
4-acetylphenylboronic acid

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With iodine; potassium carbonate In acetonitrile at 80℃; for 8h; Inert atmosphere; Schlenk technique; Sealed tube;	91%
With sodium nitrite In acetonitrile at 80℃; for 5h; Sealed tube;	86%
With 1,10-Phenanthroline; oxygen; potassium iodide; copper(ll) bromide In N,N-dimethyl-formamide at 80℃; for 20h;	76%

: 350-47-0
1-(4-acetylphenyl)diazonium tetrafluoroborate

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With N-iodo-succinimide; sodium nitrite In dimethyl sulfoxide at 20℃; for 2.5h;	90%
With diiodomethane; tetrabutylammonium perchlorate In methanol; N,N-dimethyl-formamide at 20℃; for 3h; Sandmeyer Reaction; Electrochemical reaction;	87%

: 591-50-4
iodobenzene

: 1942-30-9
4-(phenylethynyl)nitrobenzene

: 88284-48-4
2-(trimethylsilyl)phenyl trifluoromethanesulfonate

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With thallium(I) acetate; cesium fluoride; bis(dibenzylideneacetone)-palladium(0) In toluene; acetonitrile at 90℃; for 8h;	89%

...Expand

: 561023-21-0
1-iodo-4-(prop-1-en-2-yl)benzene

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With sodium tetrafluoroborate; [Cu(salicylate)2(NCMe)]2; tetrabutyl-ammonium chloride; oxygen In tetrahydrofuran at 60℃; for 12h;	85%

: 201230-82-2
carbon monoxide

: 624-38-4
para-diiodobenzene

: 143-36-2
methylmercury(II) iodide

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With dichloro bis(acetonitrile) palladium(II); tetra-(n-butyl)ammonium iodide In N,N,N,N,N,N-hexamethylphosphoric triamide under 760 Torr; for 5.5h; Ambient temperature;	83%

...Expand

: 99-92-3
4-Aminoacetophenone

: 82113-65-3
bis(trifluoromethanesulfonyl)amide

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
Stage #1: bis(trifluoromethanesulfonyl)amide With tert.-butylnitrite; acetic acid In ethanol Cooling with ice; Stage #2: p-aminobenzophenone With tetraethylammonium iodide In water at 20℃;	81%

: 201230-82-2
carbon monoxide

: 594-27-4
tetramethylstannane

: 1514-50-7
4-iodobenzenediazonium tetrafluoroborate

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
palladium diacetate In acetonitrile under 6619.6 Torr; for 1.5h; Heating;	79%
With palladium diacetate In acetonitrile for 0.5h; Ambient temperature;	79%

...Expand

: 19073-16-6
4-(2-methyl-[1,3]dioxolan-2-yl)-phenylamine

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With N-iodo-succinimide; sodium nitrite In N,N-dimethyl-formamide at 20℃; for 4h;	75%
Multi-step reaction with 2 steps 1: sodium nitrite; N-iodo-succinimide / N,N-dimethyl-formamide / 4 h / 20 °C 2: sodium nitrite; N-iodo-succinimide / N,N-dimethyl-formamide / 4 h / 20 °C View Scheme
Multi-step reaction with 3 steps 1: sodium nitrite; N-iodo-succinimide / N,N-dimethyl-formamide / 4 h / 20 °C 2: tert.-butylnitrite / water; ethanol / 2 h / 0 - 20 °C 3: sodium nitrite; N-iodo-succinimide / dimethyl sulfoxide / 2.5 h / 20 °C View Scheme

: 25309-64-2
4-ethyl-1-iodobenzene

A: 13329-40-3
4-Iodoacetophenone

B: 68120-56-9, 104013-25-4, 53207-29-7
1-(4-iodophenyl)ethanol

Conditions

Conditions	Yield
With 1-hydroxy-1,2-benzodioxol-3-(1H)-one; tris(2,2'-bipyridyl)ruthenium dichloride; water at 30℃; for 10h; Reagent/catalyst; Irradiation; Inert atmosphere;	A 8% B 71%

: 60514-82-1
2-(4-iodophenyl)propan-2-ol

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With bismuth(lll) trifluoromethanesulfonate; dipotassium peroxodisulfate; silver nitrate In water at 30℃; for 24h; Inert atmosphere; Green chemistry;	71%

: 25309-64-2
4-ethyl-1-iodobenzene

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; C26H23ClN8ORu In water at 20℃; for 2h; Catalytic behavior; Schlenk technique;	66%
With tert.-butylhydroperoxide at 90℃; for 5h; Neat (no solvent);
With calcined praseodymium incorporated AlPO-5 molecular sieves ((Al+P)/Pr = 25); air In neat liquid at 120℃; for 6h; Green chemistry;
With oxygen; Langlois reagent In acetonitrile at 25℃; under 760.051 Torr; for 12h; Irradiation; Green chemistry;	96 %Chromat.

: 920-66-1
1,1,1,3',3',3'-hexafluoro-propanol

: 92527-07-6
1-(4-(dichloro-λ3-iodanyl)phenyl)ethan-1-one

A: 13329-40-3
4-Iodoacetophenone

B: 684-16-2
Hexafluoroacetone

Conditions

Conditions	Yield
In dichloromethane-d2 at 20℃; for 20h; Inert atmosphere;	A 65% B n/a

...Expand

: 19073-16-6
4-(2-methyl-[1,3]dioxolan-2-yl)-phenylamine

A: 13329-40-3
4-Iodoacetophenone

B: 99-92-3
4-Aminoacetophenone

Conditions

Conditions	Yield
With N-iodo-succinimide; sodium nitrite In N,N-dimethyl-formamide at 20℃; for 4h;	A 31% B 62%

: 586-89-0
4-acetyl-benzoic acid

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With tris-(dibenzylideneacetone)dipalladium(0); 1-iodo-butane; N,N,N',N'-tetramethyl-1,8-diaminonaphthalene; chloro-N,N,N',N'-bis(tetramethylene)formamidinium hexafluorophosphate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In toluene at 120℃; for 16h; Sealed tube; Inert atmosphere;	62%

: potassium 4-acetylphenyltrifluoroborate

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With chloroamine-T; sodium iodide In tetrahydrofuran; water at 20℃; for 1.5h;	60%

: 135774-36-6
α-(benzoyloxy)-p-iodoacetophenone

A: 13329-40-3
4-Iodoacetophenone

B: 33868-50-7
phenacyl benzoate

Conditions

Conditions	Yield
With 1,3-dimethyl-2-phenyl-2,3-dihydro-1H-benzo[d]imidazole; azobisisobutyronitrile In acetonitrile at 61℃; for 19h; Rate constant;	A 19.6% B 35%

: 460088-33-9
1-(4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl)ethan-1-one

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With chloroamine-T; sodium iodide In tetrahydrofuran for 6h;	30%

: 591-50-4
iodobenzene

: 75-36-5
acetyl chloride

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
With carbon disulfide; aluminium trichloride
With aluminium trichloride
With aluminum (III) chloride In dichloromethane at 40℃; for 24h; Friedel-Crafts Acylation; Sealed tube; Inert atmosphere;

: 917-54-4
methyllithium

: 1711-02-0
4-iodobenzoic acid chloride

: 13329-40-3
4-Iodoacetophenone

Conditions

Conditions	Yield
(i) CuI, Et2O, (ii) /BRN= 774718/, MeOH; Multistep reaction;

: 591-50-4
iodobenzene

: 13329-40-3
4-Iodoacetophenone

: 13329-40-3
4-Iodoacetophenone

: 31827-94-8
2-bromo-1-(4-iodophenyl)ethanone

Conditions

Conditions	Yield
With bromine In 1,4-dioxane at 20℃; for 1h;	100%
With bromine In 1,4-dioxane at 0 - 20℃; for 1 - 1.66667h; Product distribution / selectivity;	100%
With bromine In chloroform at 20℃; for 4h;	94%

: 13329-40-3
4-Iodoacetophenone

: 123-11-5
4-methoxy-benzaldehyde

: 92855-02-2
(E)-1-(4-iodophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one

Conditions

Conditions	Yield
With potassium hydroxide In ethanol; water at 20℃; for 4.25h; Cooling with ice;	100%
With sodium hydroxide In methanol at 0 - 20℃; for 4h; Claisen-Schmidt condensation;	91%
With SiO2-H3PO4 Aldol Condensation; Microwave irradiation;	88%

: 13329-40-3
4-Iodoacetophenone

: 68120-56-9, 104013-25-4, 53207-29-7
1-(4-iodophenyl)ethanol

Conditions

Conditions	Yield
With zirconium dioxide hydrate; isopropyl alcohol at 130℃; for 0.366667h; Meerwein-Ponndorf-Verley Reduction;	100%
With C9H8BrMnN2O3; potassium tert-butylate In isopropyl alcohol at 30℃; for 168h; Inert atmosphere; Schlenk technique; Glovebox;	99%
With sodium tetrahydroborate In ethanol for 5h;	98.7%

: 13329-40-3
4-Iodoacetophenone

: 98-86-2
acetophenone

Conditions

Conditions	Yield
With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; cesium fluoride In 2-pentanol at 100℃; for 36h; Inert atmosphere;	100%
With triethylamine In toluene at 20℃; for 24h; Inert atmosphere; Irradiation; Sealed tube;	83.4%
With tris-(trimethylsilyl)silane In acetonitrile Schlenk technique; Inert atmosphere; Irradiation;	80%

: 13329-40-3
4-Iodoacetophenone

: 536-74-3
phenylacetylene

: 1942-31-0
4-(phenylethinyl)acetophenone

Conditions

Conditions	Yield
With tetrabutylammonium acetate; copper aluminum In N,N-dimethyl-formamide at 110℃; for 24h; Sonogashira coupling;	100%
With copper(l) iodide; triethylamine; triphenylphosphine In water at 60℃; for 24h; Sonogashira Cross-Coupling; Schlenk technique; Inert atmosphere;	100%
With sodium phosphate dodecahydrate In water; isopropyl alcohol at 80℃; for 1h; Reagent/catalyst; Sonogashira Cross-Coupling; Inert atmosphere;	100%

: 13329-40-3
4-Iodoacetophenone

: 292638-85-8
acrylic acid methyl ester

: 71348-24-8, 71348-27-1
methyl (2E)-3-(4-acetylphenyl)acrylate

Conditions

Conditions	Yield
With PdCl2[4,4'-bis(n-C10F21CH2OCH2)-2,2'-bipyridine]; triethylamine In N,N-dimethyl-formamide at 145℃; for 0.167h; Catalytic behavior; Reagent/catalyst; Heck Reaction; Microwave irradiation;	100%
With trihexyl(tetradecyl)phosphonium chloride; sodium acetate; palladium diacetate In water at 50℃; for 2h; Heck reaction;	99%
With C42H50Cl2N6Pd; sodium formate; triethylamine In N,N-dimethyl-formamide at 80℃; Heck Reaction; diastereospecific reaction;	99%

: 13329-40-3
4-Iodoacetophenone

: tetrabutylammonium triphenyldifluorosilicate

: 92-91-1
biphenyl-4-acetaldehyde

Conditions

Conditions	Yield
bis(η3-allyl-μ-chloropalladium(II)) In N,N-dimethyl-formamide at 95℃; for 21h;	100%

: 13329-40-3
4-Iodoacetophenone

: 220089-24-7
(R)-(+)-1-(4-iodophenyl)ethanol

Conditions

Conditions	Yield
With magnesium chloride In isopropyl alcohol at 25℃; pH=7; Catalytic behavior;	100%
With (S,S)-RuCl2(2,2'-bis(di-3,5-xylylphosphino)-1,1'-binaphthyl)(1,1-dianisyl-2-isopropyl-1,2-ethylenediamine); potassium tert-butylate; hydrogen In isopropyl alcohol at 26 - 30℃; under 6080 Torr; for 4h;	99.7%
With C37H40MnN2O2P2(1+)*Br(1-); sodium t-butanolate In isopropyl alcohol at 50℃; for 3h; Inert atmosphere; Schlenk technique; enantioselective reaction;	98%

: 13329-40-3
4-Iodoacetophenone

: 321155-45-7
(E)-2-pyridyldimethyl-(2-thien-2-ylethenyl)silane

: 63483-65-8
(E)-1-(4-acetyl)phenyl-2-(2-thienyl)ethene

Conditions

Conditions	Yield
With bis(benzonitrile)palladium(II) dichloride; tetrabutyl ammonium fluoride In tetrahydrofuran at 60℃; Hiyama coupling;	100%

: 141-32-2
acrylic acid n-butyl ester

: 13329-40-3
4-Iodoacetophenone

: 173464-57-8
(E)-3-(4-acetylphenyl)acrylic acid butyl ester

Conditions

Conditions	Yield
With C29H33Cl2N5Pd; tetrabutylammomium bromide; sodium carbonate In N,N-dimethyl acetamide at 140℃; for 3h; Heck reaction; Inert atmosphere;	100%
With tributyl-amine; chloro-[2-(9-phenyl-1,10-phenanthrolin-2-yl)phenyl]palladium In 1-methyl-pyrrolidin-2-one at 140℃; for 15h; Heck Reaction; Inert atmosphere;	100%
With phenyl carbamate; potassium carbonate; palladium diacetate In N,N-dimethyl-formamide at 130℃; for 2h; Heck-type reaction;	99%

: 13329-40-3
4-Iodoacetophenone

: 5720-06-9
2-Methoxyphenylboronic acid

: 52807-17-7
4-acetyl-2'-methoxybiphenyl

Conditions

Conditions	Yield
With trihexyl(tetradecyl)phosphonium chloride; potassium phosphate; tris(dibenzylideneacetone)dipalladium(0) chloroform complex In toluene at 50℃; for 1h; Suzuki cross-coupling;	100%
With caesium carbonate; tetrakis(triphenylphosphine) palladium(0) In tetrahydrofuran Suzuki cross-coupling reaction; Heating;

: 13329-40-3
4-Iodoacetophenone

: 98-80-6
phenylboronic acid

: 92-91-1
biphenyl-4-acetaldehyde

Conditions

Conditions	Yield
With trihexyl(tetradecyl)phosphonium chloride; potassium phosphate; tris(dibenzylideneacetone)dipalladium(0) chloroform complex In toluene at 50℃; for 1h; Suzuki cross-coupling;	100%
Stage #1: 4-Iodoacetophenone With tetrakis(triphenylphosphine) palladium(0) In 1-butyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide at 20 - 110℃; Suzuki coupling; Inert atmosphere; Ionic liquid; Stage #2: phenylboronic acid With triethylamine In 1-butyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide; water at 20 - 110℃; Suzuki coupling; Ionic liquid; Inert atmosphere;	100%
With potassium carbonate In ethanol; water at 20℃; for 0.5h; Suzuki-Miyaura reaction; in air;	100%

: 13329-40-3
4-Iodoacetophenone

: 115-19-5
2-methyl-but-3-yn-2-ol

: 95785-28-7
1-(4-acetylphenyl)-3-methyl-1-butyn-3-ol

Conditions

Conditions	Yield
With copper(l) iodide; 1-isobutyl-2,2,6,6-tetramethyl-phosphorinane*HBF4; diisopropylamine; bis(benzonitrile)palladium(II) dichloride In 1,4-dioxane at 20℃; for 6h; Sonogashira reaction;	100%
With piperidine; copper(l) iodide; polystyrene-N(CH2PPh2)2PdCl2 In 1,4-dioxane at 60℃; for 2h; Sonogashira coupling reaction;	94%
With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine at 20℃; Inert atmosphere;	90%

: 13329-40-3
4-Iodoacetophenone

: 14235-81-5
4-Ethynylaniline

: 123770-68-3
4-((4-aminophenyl)ethynyl)acetophenone

Conditions

Conditions	Yield
With triethylamine In water at 80℃; for 0.5h; Sonogashira Cross-Coupling;	100%
With triethylamine; Nd2.04Cu0.95Pd0.05O4 In N,N-dimethyl-formamide at 120℃; for 16h; Sonogashira reaction;	92%
With Pd/SiO2; triethylamine In diethyl ether; water at 20℃; for 10h; Sonogashira Cross-Coupling;	86%

: 13329-40-3
4-Iodoacetophenone

: 99-93-4
4-Hydroxyacetophenone

Conditions

Conditions	Yield
With sodium hydroxide; copper(l) iodide; L-proline In water at 20 - 300℃; microwave irradiation;	100%
Stage #1: 4-Iodoacetophenone With copper(l) iodide; tetra(n-butyl)ammonium hydroxide In water at 60℃; for 24h; Inert atmosphere; Sealed tube; Stage #2: With hydrogenchloride In water; ethyl acetate at 20℃; for 2h; Inert atmosphere; chemoselective reaction;	96%
With copper(l) iodide; potassium hydroxide In water at 100℃; Inert atmosphere;	96%

: 110-18-9
N,N,N,N,-tetramethylethylenediamine

: 13329-40-3
4-Iodoacetophenone

: 32005-36-0
bis(dibenzylideneacetone)-palladium(0)

: 191667-17-1
PdI(4-MeCOC6H4)(N,N,N',N'-tetramethylethylenediamine)

Conditions

Conditions	Yield
In not given byproducts: dibenzylideneacetone; N2-atmosphere; according to Markies, A. J. et al.: J. Organomet. Chem. 482 (1994) 191; elem. anal.;	100%

...Expand

: 1663-39-4
tert-Butyl acrylate

: 13329-40-3
4-Iodoacetophenone

: 389091-50-3
(E)-tert-butyl 3-(4-acetylphenyl)prop-2-enoate

Conditions

Conditions	Yield
With tetrabutyl ammonium fluoride; palladium dichloride at 40℃; for 3h; Heck reaction; Inert atmosphere; neat (no solvent);	100%
With tributyl-amine In N,N-dimethyl-formamide at 120℃; Heck-Mizoroki reaction;	99%
With di-μ-iodobis(tri-tert-butylphosphino)dipalladium(l); N-ethyl-N,N-diisopropylamine In toluene at 100℃; for 15h; Heck Reaction; Inert atmosphere; Sealed tube; Glovebox;	99%

: 13329-40-3
4-Iodoacetophenone

: 292638-85-8
acrylic acid methyl ester

: methyl 4-acetylcinnamate

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 120℃; for 0.25h; Heck Reaction;	100%
With triethylamine In water; acetonitrile at 120℃; for 3h; Heck Reaction; Green chemistry;	99%
With 3C22H14N3O2(1-)Ho(3+)Pd(2+)*2Cl(1-); potassium carbonate In N,N-dimethyl-formamide at 100℃; for 1h; Heck Reaction;	99%

: 40667-81-0
(4-methylphenyl)gold(triphenylphosphine)

: 13329-40-3
4-Iodoacetophenone

: 123770-66-1
1-{4-[2-(4-methylphenyl)ethynyl]phenyl}ethanone

Conditions

Conditions	Yield
With bis-triphenylphosphine-palladium(II) chloride; diisopropylamine; 1,2-bis-(diphenylphosphino)ethane In toluene at 130℃; for 16h; Sonogashira coupling; Inert atmosphere;	100%

: 13329-40-3
4-Iodoacetophenone

: 1046337-99-8
4,4-dimethyl-1-phenyl-1-(pyridin-2-yl)pent-2-yn-1-ol

: 1227746-69-1
2-(4-acetylphenyl)-3-tert-butyl-8a-phenylindolizin-1(8aH)-one

Conditions

Conditions	Yield
With tetrakis(triphenylphosphine) palladium(0); potassium carbonate In acetonitrile at 90℃; for 13h;	100%

: 13329-40-3
4-Iodoacetophenone

: 87446-01-3
3-phenyl-1,1-di(pyridin-2-yl)prop-2-yn-1-ol

: 1383711-44-1
2-(4-acetylphenyl)-3-phenyl-8a-(pyridin-2-yl)indolizin-1(8aH)-one

Conditions

Conditions	Yield
With tetrakis(triphenylphosphine) palladium(0); potassium carbonate In acetonitrile at 90℃; for 13h;	100%

: 13329-40-3
4-Iodoacetophenone

: 27760-43-6
1-(4-iodophenyl)ethan-1-one oxime

Conditions

Conditions	Yield
With hydroxylamine hydrochloride; sodium acetate In ethanol; water at 95℃;	100%
With hydroxylamine hydrochloride; sodium hydroxide In methanol at 20℃; Green chemistry;	78%
With hydroxylamine hydrochloride; sodium acetate In ethanol; water for 1h; Reflux;

: 13329-40-3
4-Iodoacetophenone

: 17933-03-8
m-tolylboronic acid

: 76650-29-8
4-acetyl-3'-methylbiphenyl

Conditions

Conditions	Yield
With potassium carbonate In water; N,N-dimethyl-formamide at 80℃; for 0.333333h; Suzuki-Miyaura Coupling; Green chemistry;	100%
With potassium carbonate In water at 25℃; for 2h; Suzuki Coupling; Schlenk technique;	98%
With potassium carbonate In water at 20℃; for 4h; Catalytic behavior; Suzuki-Miyaura Coupling;	100 %Chromat.

: 18711-13-2
4,7-dichloroisatin

: 13329-40-3
4-Iodoacetophenone

: 1037184-42-1
4,7-dichloro-3-hydroxyl-3-[2-(4-iodophenyl-2-oxoethyl)]-1,3-dihydroindol-2-one

Conditions

Conditions	Yield
With diethylamine In methanol at 20℃;	100%

: 13329-40-3
4-Iodoacetophenone

: 2-(2-(4-bromophenyl)-4-(4-ethylphenyl)-5-(4-methoxyphenyl)furan-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

: 1-(4-(2-(4-bromophenyl)-4-(4-ethylphenyl)-5-(4-methoxyphenyl)furan-3-yl)phenyl)ethan-1-one

Conditions

Conditions	Yield
With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium hydroxide In tetrahydrofuran at 20℃; for 12h; Inert atmosphere; Schlenk technique;	100%

: 13329-40-3
4-Iodoacetophenone

: 787-69-9
4,4'-diacetylbiphenyl

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine; [2-(Pd-Cl)-4,4'-dichlorobenzophenone oxime]2 In decane; N,N-dimethyl-formamide at 110℃; for 5h; Ullmann homocoupling;	99%
With potassium iodide; nickel dibromide; zinc In N,N,N,N,N,N-hexamethylphosphoric triamide; N,N-dimethyl-formamide at 50℃; for 3h;	98%
With potassium phosphate In water at 110℃; for 48h; Ullmann Condensation;	98%

: 109-72-8, 29786-93-4
n-butyllithium

: 13329-40-3
4-Iodoacetophenone

: 84735-52-4
2-(4-iodophenyl)-2-hexanol

Conditions

Conditions	Yield
With cerium(III) triiodide In tetrahydrofuran; hexane at -65℃; for 3h;	99%
Stage #1: n-butyllithium With cerium(III) chloride at -78℃; Stage #2: 4-Iodoacetophenone at -78℃;	93%
With cerium(III) triiodide in THF, 1) -65 deg C, 30 min., 2) -65 deg C, 3h; Yield given. Multistep reaction;

: 64-17-5
ethanol

: 13329-40-3
4-Iodoacetophenone

: 201230-82-2
carbon monoxide

: 38430-55-6
ethyl-4-acetylbenzoate

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene; palladium diacetate at 20 - 125℃; under 7500.75 - 22502.3 Torr; for 0.333333h; microwave irradiation;	99%
With 1,8-diazabicyclo[5.4.0]undec-7-ene; palladium diacetate at 125℃; under 7757.43 Torr; for 0.333333h; microwave irradiation;	97%
With triethylamine at 100℃; under 3750.38 Torr; for 1.5h; Inert atmosphere;	96%

...Expand

: 13329-40-3
4-Iodoacetophenone

: 79-10-7
acrylic acid

: 18910-24-2
4-acetylcinnamic acid

Conditions

Conditions	Yield
With potassium hydroxide In water at 90℃; for 5h; Mizoroki-Heck reaction;	99%
With potassium hydroxide In methanol at 80℃; for 24h; Heck reaction;	65%
With sodium carbonate; palladium dichloride In water at 100℃; Yield given;
With palladium diacetate; potassium carbonate In water at 120℃; for 0.416667h; Heck reaction; Microwave irradiation;
With potassium carbonate In water at 90℃; for 12h; Heck Reaction; Inert atmosphere;

4'-Iodoacetophenone Specification

The Ethanone,1-(4-iodophenyl)-, with CAS registry number 13329-40-3, belongs to the following product categories: (1)Aromatic Acetophenones & Derivatives (substituted); (2)API intermediates; (3)Adehydes, Acetals & Ketones; (4)Iodine Compounds; (5)C7 to C8; (6)Carbonyl Compounds; (7)Ketones. It has the systematic name of 1-(4-iodophenyl)ethanone. This chemical is a kind of pale brown to brown crystalline powder.

Physical properties of Ethanone,1-(4-iodophenyl)-: (1)ACD/LogP: 2.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.87; (4)ACD/LogD (pH 7.4): 2.87; (5)ACD/BCF (pH 5.5): 88.69; (6)ACD/BCF (pH 7.4): 88.69; (7)ACD/KOC (pH 5.5): 862.81; (8)ACD/KOC (pH 7.4): 862.81; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 49.18 cm³; (15)Molar Volume: 143 cm³; (16)Polarizability: 19.49×10^-24cm³; (17)Surface Tension: 43.8 dyne/cm; (18)Enthalpy of Vaporization: 51.86 kJ/mol; (19)Vapour Pressure: 0.0039 mmHg at 25°C.

Uses of Ethanone,1-(4-iodophenyl)-: it can be used to produce 4,4'-Diacetyl-biphenyl. This reaction will need reagent triethylamine, t-butylmethylbenzyl sulfide, phenyl halide and solvent dimethylformamide. The reaction time is 24 hour(s) with reaction temperature of 130 ℃. The yield is about 82%.

When you are using this chemical, please be cautious about it as the following:
The Ethanone,1-(4-iodophenyl)- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(I)cc1)C
(2)InChI: InChI=1/C8H7IO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
(3)InChIKey: JZJWCDQGIPQBAO-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C8H7IO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
(5)Std. InChIKey: JZJWCDQGIPQBAO-UHFFFAOYSA-N

Product Name

4'-Iodoacetophenone

Synthetic route

4'-Iodoacetophenone Specification

Related Products

Hot Products