Conditions | Yield |
---|---|
With dibenzo-18-crown-6; potassium bromide; copper(ll) bromide; 1,10-Phenanthroline; copper(I) bromide In acetonitrile at 20℃; for 0.333333h; Sandmeyer bromination; | 99% |
With N-Bromosuccinimide; tetrabutylammonium perchlorate In methanol; N,N-dimethyl-formamide at 20℃; for 3h; Sandmeyer Reaction; Electrochemical reaction; | 52% |
Conditions | Yield |
---|---|
With sulfuric acid; tetramethylammonium bromide at 120℃; for 3h; Product distribution; Further Variations:; Reagents; | 98% |
With sulfuric acid; potassium bromide at 60℃; for 2h; | 95% |
With Oxone; sodium bromide In water at 20℃; for 3h; regioselective reaction; | 90% |
p-Toluolsulfonylnitrit
A
bromochlorobenzene
B
N,N'-bis(p-toluenesulfonyl)hydroxylamine
Conditions | Yield |
---|---|
With 4-bromo-aniline; copper dichloride In acetonitrile at 25℃; for 1h; | A 93% B 83% |
4-bromo-aniline
A
bromochlorobenzene
B
N,N'-bis(p-toluenesulfonyl)hydroxylamine
Conditions | Yield |
---|---|
With p-toluenesulfonyl nitrite; copper dichloride In acetonitrile for 0.75h; | A 93% B n/a |
Conditions | Yield |
---|---|
With sodium nitrite In acetonitrile at 80℃; for 1h; Sealed tube; | 93% |
With N-Bromosuccinimide In acetonitrile at 81℃; for 8h; | 65% |
bromochlorobenzene
Conditions | Yield |
---|---|
In dimethyl sulfoxide Ambient temperature; | 92% |
4-bromo-2,4,6-trimethyldiphenyliodonium trifluoromethanesulfonate
bromochlorobenzene
Conditions | Yield |
---|---|
With copper(l) chloride In acetonitrile at 80℃; for 2h; | 89% |
(4-chlorophenyl)(mesityl)iodonium trifluoromethanesulfonate
bromochlorobenzene
Conditions | Yield |
---|---|
With copper(I) bromide In acetonitrile at 80℃; for 2h; | 85% |
Conditions | Yield |
---|---|
With N-chloro-succinimide; sodium nitrite In N,N-dimethyl-formamide at 20℃; for 6h; | 83% |
With tert.-butylnitrite; N-benzyl-N,N,N-triethylammonium chloride; copper dichloride; 10-camphorsulfonic acid In acetonitrile at 20℃; for 24h; Time; Solvent; | 43% |
Conditions | Yield |
---|---|
With methanesulfonic acid; tetrabutyl-ammonium chloride; copper In acetonitrile at 40℃; for 0.25h; | 82% |
potassium 4-bromophenyltrifluoroborate
bromochlorobenzene
Conditions | Yield |
---|---|
With trichloroisocyanuric acid In water; ethyl acetate at 20℃; for 1h; Open flask; | 81% |
4-chloro-aniline
A
bromochlorobenzene
B
N,N'-bis(p-toluenesulfonyl)hydroxylamine
Conditions | Yield |
---|---|
With p-toluenesulfonyl nitrite; copper(ll) bromide In acetonitrile at 25℃; for 0.0166667h; | A 79% B n/a |
Conditions | Yield |
---|---|
With phenylphosphorus tetrachloride at 160℃; | 78% |
bromochlorobenzene
Conditions | Yield |
---|---|
With tetrabutylammomium bromide; copper In acetonitrile at 20℃; for 0.75h; Substitution; | 75% |
With tetrabutylammomium bromide In acetonitrile at 60℃; for 0.75h; Substitution; | 73% |
Multi-step reaction with 2 steps 1: 90 percent / aq. NaOH / 0.5 h / 0 - 5 °C 2: 82 percent / Bu4N(+)Cl(-); MeSO3H; Cu / acetonitrile / 0.25 h / 40 °C View Scheme |
bromochlorobenzene
Conditions | Yield |
---|---|
With N-benzyl-N,N,N-triethylammonium chloride; copper In acetonitrile at 20℃; Substitution; | 74% |
Conditions | Yield |
---|---|
With boron tribromide; dimethyl sulfoxide at 80℃; for 1h; | 72% |
4-chlorophenyldiazonium salt
bromochlorobenzene
Conditions | Yield |
---|---|
With tin(II); chloride; copper(II) nitrate In water for 0.5h; Ambient temperature; | 70% |
With copper(I) bromide |
Conditions | Yield |
---|---|
With N-Bromosuccinimide; sodium nitrite In N,N-dimethyl-formamide at 20℃; for 6h; | 68% |
With tert.-butylnitrite; tetrabutylammomium bromide; copper(I) bromide; 10-camphorsulfonic acid In acetonitrile at 20℃; for 24h; Reagent/catalyst; Time; Solvent; | 61% |
With tert.-butylnitrite; tetrabutylammomium bromide; toluene-4-sulfonic acid; copper(ll) bromide In acetonitrile at 20℃; for 23h; | 58% |
2-methylenesuccinic acid
(4-bromophenyl)diazonium chloride
A
bromochlorobenzene
B
C11H10BrClO4
Conditions | Yield |
---|---|
With copper(II) choride dihydrate In [(2)H6]acetone; water at 25℃; for 2.5h; Meerwein Arylation; | A n/a B 62% |
Conditions | Yield |
---|---|
With N-Bromosuccinimide; iron(III) chloride In acetonitrile for 2h; | A 57% B 38% |
With potassium bromate In sulfuric acid; acetic acid for 1h; Heating; Yields of byproduct given; | A 52% B n/a |
With potassium bromate In sulfuric acid; acetic acid for 1h; Heating; Yield given; | A 52% B n/a |
Conditions | Yield |
---|---|
With lead(IV) acetate; tin(IV) chloride In dichloromethane for 20h; | 56% |
With thallium chloride at 100℃; durch Chlorierung; | |
With iron(III) chloride |
1-(4-chlorophenyl)silatrane
bromochlorobenzene
Conditions | Yield |
---|---|
With N-Bromosuccinimide In dichloromethane for 8h; Ambient temperature; | 52% |
Trichloroethylene
(4-bromophenyl)diazonium chloride
A
bromochlorobenzene
B
1-Brom-4-<1,2,2,2-tetrachlor-ethyl>-benzol
Conditions | Yield |
---|---|
With potassium chloride; copper dichloride In water; acetone | A n/a B 52% |
(4-bromophenyl)diazonium chloride
A
bromochlorobenzene
B
1-Brom-4-<1,2,2,2-tetrachlor-ethyl>-benzol
Conditions | Yield |
---|---|
With Trichloroethylene; potassium chloride; copper dichloride In water; acetone | A n/a B 52% |
C7H6ClN7
bromochlorobenzene
Conditions | Yield |
---|---|
With tetrabutylammomium bromide; trifluoroacetic acid In acetonitrile at 70 - 80℃; | 40% |
p-chlorobenzenediazonium tetrafluoroborate
A
bromochlorobenzene
B
1-Chloro-4-fluorobenzene
C
chlorobenzene
Conditions | Yield |
---|---|
With trimethylsilyl bromide; 3-butyl-1-methyl-1H-imidazol-3-ium hexafluorophosphate; copper(I) bromide at 70℃; Schiemann reaction; | A 4% B 61 % Chromat. C 35% |
Conditions | Yield |
---|---|
With tert-Butyl thionitrate; Bromoform for 0.5h; Heating; | 25% |
Conditions | Yield |
---|---|
With bromine trifluoride; bromine at 0 - 10℃; | A 25% B 5% |
Conditions | Yield |
---|---|
With bromine; mercury(II) oxide In nitrobenzene at 180 - 185℃; for 2h; | 22% |
Conditions | Yield |
---|---|
With [Pd{C6H4(CH2N(CH2Ph)2)}(μ-Br)]2; potassium carbonate In 1-methyl-pyrrolidin-2-one at 130℃; for 3h; Microwave irradiation; chemoselective reaction; | 100% |
Stage #1: bromochlorobenzene With tert.-butyl lithium In diethyl ether at -78℃; Stage #2: In diethyl ether Stage #3: With Duroquinone In diethyl ether | 96% |
With potassium carbonate In N,N-dimethyl-formamide for 0.666667h; | 96% |
Conditions | Yield |
---|---|
With potassium hydroxide; hydrogen; palladium on activated charcoal; Aliquat 336 In water at 50℃; for 0.833333h; | 100% |
With di-tert-butyl peroxide; caesium carbonate; isopropyl alcohol at 120℃; for 3h; Inert atmosphere; | 93 %Chromat. |
With ammonium formate In methanol at 20℃; for 16h; |
Conditions | Yield |
---|---|
With potassium carbonate In ethanol at 80℃; for 36h; Suzuki-Miyaura Coupling; Inert atmosphere; | 100% |
With C28H38Cl2N2O6PdS2(2-)*2Na(1+); tetrabutylammomium bromide; potassium carbonate In water at 75℃; Suzuki coupling; Inert atmosphere; | 99% |
With Br(1-)*C28H29BrN5O2Pd(1+); potassium carbonate In methanol; water at 100℃; for 3h; Suzuki-Miyaura coupling; | 99% |
Conditions | Yield |
---|---|
With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; palladium 10% on activated carbon; sodium t-butanolate In 1,3,5-trimethyl-benzene for 24h; Inert atmosphere; Reflux; | 100% |
With tris-(dibenzylideneacetone)dipalladium(0); tri-tert-butyl phosphine; sodium t-butanolate In toluene at 80℃; | 90.7% |
With tris-(dibenzylideneacetone)dipalladium(0); johnphos; sodium t-butanolate In toluene at 100℃; for 24h; Buchwald-Hartwig Coupling; Sealed tube; Inert atmosphere; | 79% |
bromochlorobenzene
tert-butyl 1,4-diazepine-1-carboxylate
tert-butyl 4-(4-chlorophenyl)-1,4-diazepane-1-carboxylate
Conditions | Yield |
---|---|
With sodium t-butanolate; tris-(dibenzylideneacetone)dipalladium(0); 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl In toluene for 23h; Heating / reflux; | 100% |
With sodium t-butanolate; tris-(dibenzylideneacetone)dipalladium(0); 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl In toluene for 23h; Heating / reflux; | 100% |
bromochlorobenzene
potassium 3-aminothiophene-2-carboxylate
3-amino-2-(4-chlorophenyl)thiophene
Conditions | Yield |
---|---|
With 1,1'-bis-(diphenylphosphino)ferrocene; tetrabutylammomium bromide; palladium dichloride In 1-methyl-pyrrolidin-2-one at 100℃; Inert atmosphere; | 100% |
With 1,1'-bis-(diphenylphosphino)ferrocene; tetrabutylammomium bromide; palladium dichloride In 1-methyl-pyrrolidin-2-one; N,N-dimethyl-formamide at 80℃; for 16h; Inert atmosphere; | 77% |
4-tributylstannanyl-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
bromochlorobenzene
4-(4-Chloro-phenyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
Conditions | Yield |
---|---|
With tetrakis(triphenylphosphine) palladium(0) In toluene at 120℃; for 17h; | 100% |
bromochlorobenzene
tert-butyl (3aR,6aS)-5-methylene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
Conditions | Yield |
---|---|
Stage #1: tert-butyl (3aR,6aS)-5-methylene-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate With 9-bora-bicyclo[3.3.1]nonane In tetrahydrofuran at 65℃; for 1h; Stage #2: bromochlorobenzene With dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2; potassium carbonate In tetrahydrofuran; 1,4-dioxane; water at 65℃; for 48h; | 100% |
Conditions | Yield |
---|---|
With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; cesium fluoride In 2-pentanol at 100℃; for 57h; Inert atmosphere; | A 0.8% B 99.2% |
In 1,2-dimethoxyethane at 85℃; Product distribution; var. solvents; var. times; Ni from NiI2 or NiBr2; | |
With nickel In 1,2-dimethoxyethane at 85℃; for 20h; | A 61 % Chromat. B 32 % Chromat. |
Conditions | Yield |
---|---|
Stage #1: bromochlorobenzene With iodine; magnesium In diethyl ether Inert atmosphere; Reflux; Stage #2: allyl bromide In diethyl ether at 0 - 20℃; for 2.08333h; Inert atmosphere; | 99% |
(i) Mg, Et2O, (ii) /BRN= 605308/; Multistep reaction; | |
Stage #1: bromochlorobenzene With iodine; magnesium In diethyl ether for 2h; Reflux; Inert atmosphere; Stage #2: allyl bromide In diethyl ether at 20℃; Cooling with ice; Inert atmosphere; |
bromochlorobenzene
triethyl phosphite
diethyl (4-chlorophenyl)phosphonate
Conditions | Yield |
---|---|
With tri-n-propylamine; tetrabutylammomium bromide; palladium dichloride In water at 100℃; for 4h; Green chemistry; chemoselective reaction; | 99% |
With triethylamine In water at 100℃; for 5h; Green chemistry; | 92% |
With triethylamine In water at 100℃; for 5h; Arbuzov Reaction; Green chemistry; | 91% |
bromochlorobenzene
acrylic acid n-butyl ester
butyl p-chlorocinnamate
Conditions | Yield |
---|---|
With [1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene](3-chloropyridyl)palladium(ll) dichloride; tetrabutylammomium bromide; triethylamine In N,N-dimethyl-formamide at 140℃; for 20h; Reagent/catalyst; Heck Reaction; Sealed tube; Inert atmosphere; Schlenk technique; | 99% |
With potassium carbonate at 120℃; for 2.25h; Catalytic behavior; Heck Reaction; | 98% |
With potassium carbonate In N,N-dimethyl-formamide at 120℃; for 3h; Catalytic behavior; Heck Reaction; | 97% |
bromochlorobenzene
2-(6-bromo-pyridin-2-yl)-4-methylpyrimidine
Conditions | Yield |
---|---|
Stage #1: bromochlorobenzene With n-butyllithium In tetrahydrofuran Dehalogenation; Stage #2: With zinc(II) chloride In diethyl ether at 20℃; Metallation; Stage #3: 2-(6-bromo-pyridin-2-yl)-4-methylpyrimidine; tetrakis(triphenylphosphine) palladium(0) In tetrahydrofuran; diethyl ether for 2h; Substitution; Heating; | 99% |
styrene
bromochlorobenzene
A
(E)-1-(4-chlorophenyl)-2-phenylethene
B
1-(4-chlorophenyl)-1-phenylethene
Conditions | Yield |
---|---|
With sodium carbonate; Pd-montmorillonite In 1-methyl-pyrrolidin-2-one at 150℃; for 2h; Heck reaction; | A 99% B n/a |
With 1-methyl-pyrrolidin-2-one; sodium acetate; palladium diacetate at 135℃; for 15h; Heck reaction; | |
With sodium acetate; PdCl2[2-[(1-MeS-S)-3-[(Ph2P-P)oxy]propyl]-N,N-Me2-aniline] In N,N-dimethyl-formamide at 130℃; for 24h; Heck reaction; Title compound not separated from byproducts; | |
With tetrabutyl-ammonium chloride; sodium carbonate; Pd-MCM-41 In 1-methyl-pyrrolidin-2-one at 150℃; for 6h; Heck coupling; Title compound not separated from byproducts; |
Conditions | Yield |
---|---|
With potassium carbonate In water at 50℃; for 0.333333h; Suzuki Coupling; | 99% |
With sodium carbonate at 80℃; for 0.333333h; Green chemistry; | 98% |
With potassium carbonate at 100℃; for 1h; Catalytic behavior; | 97% |
Conditions | Yield |
---|---|
With copper(l) iodide; potassium carbonate; heptakis(6-amino-6-deoxy)-β-cyclodextrin In dimethyl sulfoxide at 110℃; for 24h; Sealed tube; | 99% |
With potassium carbonate In N,N-dimethyl-formamide at 100℃; for 8h; chemoselective reaction; | 98% |
With copper(I) oxide; potassium phosphate; N1,N2-bis(furan-2-ylmethyl)oxalamide In dimethyl sulfoxide at 120℃; for 24h; | 97% |
Conditions | Yield |
---|---|
Stage #1: ortho-nitrobenzoic acid With potassium carbonate In various solvent(s) at 120℃; for 0.5h; Stage #2: bromochlorobenzene With 1,10-Phenanthroline; copper(l) iodide In various solvent(s) at 160℃; for 24h; Further stages.; | 99% |
With 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; N,N-dimethyl-aniline; silver carbonate; palladium dichloride at 150℃; for 2h; | 35% |
Stage #1: ortho-nitrobenzoic acid; copper(II) carbonate In 1-methyl-pyrrolidin-2-one Stage #2: bromochlorobenzene; bis(acetylacetonato)palladium(II); triphenylphosphine In 1-methyl-pyrrolidin-2-one at 120℃; for 24h; Product distribution / selectivity; | 9 %Chromat. |
bromochlorobenzene
4-methylphenylboronic acid
4-chloro-4'-methylbiphenyl
Conditions | Yield |
---|---|
With 2C60H80NaO12*Cl6Pd2; potassium carbonate In methanol; water at 20℃; for 0.166667h; Suzuki coupling; | 99% |
With sodium hydroxide In ethanol; water at 25℃; for 4.5h; Suzuki Coupling; | 98% |
With sodium carbonate In 1-methyl-pyrrolidin-2-one at 100℃; for 10h; Suzuki-Miyaura Coupling; Inert atmosphere; | 98% |
bromochlorobenzene
acrylic acid methyl ester
A
methyl 3-(4-chlorophenyl)propenoate
B
methyl 2-(4-chlorophenyl)acrylate
Conditions | Yield |
---|---|
With sodium carbonate; Pd-montmorillonite In 1-methyl-pyrrolidin-2-one at 150℃; for 2h; Heck reaction; | A 99% B n/a |
Conditions | Yield |
---|---|
palladium diacetate In water; N,N-dimethyl-formamide at 20℃; for 5h; | 99% |
With C24H25Cl3FeN3PPd*C3H6O In ethanol; water at 80℃; for 3h; Suzuki-Miyaura Coupling; Schlenk technique; Inert atmosphere; Sealed tube; | 89% |
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 110℃; for 12h; | 99% |
With potassium carbonate In N,N-dimethyl-formamide at 110℃; | 97% |
With copper(l) iodide; iron(III)-acetylacetonate; potassium carbonate In N,N-dimethyl-formamide at 135℃; for 12h; Inert atmosphere; | 93% |
bromochlorobenzene
C17H20N2O4S
1-[1-(4-chlorophenyl)-2-methoxyvinyl]-4-methoxybenzene
Conditions | Yield |
---|---|
Stage #1: C17H20N2O4S With tris(dibenzylideneacetone)dipalladium (0); lithium tert-butoxide; XPhos In 1,4-dioxane for 0.0166667h; Inert atmosphere; Stage #2: bromochlorobenzene In 1,4-dioxane at 90℃; for 14h; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With 1,2,3,4-tetrahydroquinolin-8-ol; caesium carbonate; copper(I) bromide In N,N-dimethyl-formamide at 130℃; for 48h; Inert atmosphere; chemoselective reaction; | 99% |
Conditions | Yield |
---|---|
With triisopropoxytitanium(IV) chloride; phenyllithium In diethyl ether; cyclohexane at -78 - 20℃; for 0.25h; Inert atmosphere; enantioselective reaction; | 99% |
Stage #1: bromochlorobenzene With n-butyllithium In tetrahydrofuran; hexane at -78℃; for 0.5h; Inert atmosphere; Stage #2: With titanium(IV) isopropylate; magnesium bromide In tetrahydrofuran; diethyl ether; hexane for 0.5h; Inert atmosphere; Stage #3: benzaldehyde With titanium(IV) isopropylate; (R)-3-(3,5-diphenylphenyl)-2,2'-dihydroxy-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl In diethyl ether; dichloromethane at 0℃; for 3h; Inert atmosphere; optical yield given as %ee; enantioselective reaction; | 80% |
Multi-step reaction with 2 steps 1.1: C36H31F2N2(1+)*BF4(1-); copper(l) chloride; sodium trimethylsilanolate / toluene / 0.42 h / 25 °C / Inert atmosphere; Sealed tube 1.2: 3 h / 60 °C / Inert atmosphere; Sealed tube 2.1: tetrabutyl ammonium fluoride / Inert atmosphere View Scheme |
Conditions | Yield |
---|---|
With palladium diacetate; sodium t-butanolate; nixantphos In N,N-dimethyl-formamide at 24℃; for 12h; Heck Reaction; Inert atmosphere; | 99% |
With [(N,N'-bis-(2,6-di(isopropyl)phenyl)imidazolidin-2-ylidene)Pd(allyl)]2(μ2-trans-4,4'-bipyridylethylene)(BF4)2; lithium tert-butoxide In 1,2-dimethoxyethane at 10℃; for 12h; Catalytic behavior; Reagent/catalyst; Sealed tube; | 94% |
With palladium diacetate; copper(II) acetate monohydrate; potassium carbonate; triphenylphosphine In toluene for 3h; Reflux; under air; | 87% |
With n-butyllithium; palladium diacetate; C45H35P2(1+)*CF3O3S(1-); caesium carbonate In dimethyl sulfoxide at 50℃; for 14h; Inert atmosphere; | 85% |
Conditions | Yield |
---|---|
With copper(l) chloride; potassium hydroxide at 90℃; for 8h; Neat (no solvent); | 99% |
Conditions | Yield |
---|---|
With palladium diacetate; N-picolinoylcyclohexylamine; potassium hydrogencarbonate In tert-Amyl alcohol at 150℃; for 24h; | 99% |
bromochlorobenzene
3-(methylsulphinyl)thiophene
Conditions | Yield |
---|---|
With di(1-adamantyl)-n-butylphosphine; cesium acetate; bis(dibenzylideneacetone)-palladium(0) at 100℃; for 12h; Inert atmosphere; regioselective reaction; | 99% |
Conditions | Yield |
---|---|
With chloro(2’-amino-1,1’-biphenyl-2-yl)palladium(II) dimer; C60H54NO5P; sodium hydride In toluene at 80℃; for 12h; Inert atmosphere; enantioselective reaction; | 99% |
The 4-Bromochlorobenzene, with the CAS registry number 106-39-8, is also known as 4-Chlorophenyl bromide. It belongs to the product categories of Benzene Based Bromo; A-BAlphabetic; Alpha Sort; B; BromoChemical Class; Chloro; Halogenated; Volatiles/ Semivolatiles; Aryl; C6; Halogenated Hydrocarbons. Its EINECS number is 203-392-3. This chemical's molecular formula is C6H4BrCl and molecular weight is 191.45. What's more, its systematic name is 1-Bromo-4-chlorobenzene. Its classification code is Mutation data. This chemical should be sealed and stored in a cool and ventilated place. Moreover, it should be protected from oxides, heat and fire. It is used as solvent and organic synthesis intermediate.
Physical properties of 4-Bromochlorobenzene are: (1)ACD/LogP: 3.462; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.46; (4)ACD/LogD (pH 7.4): 3.46; (5)ACD/BCF (pH 5.5): 251.62; (6)ACD/BCF (pH 7.4): 251.62; (7)ACD/KOC (pH 5.5): 1819.97; (8)ACD/KOC (pH 7.4): 1819.97; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.575; (13)Molar Refractivity: 38.838 cm3; (14)Molar Volume: 117.569 cm3; (15)Polarizability: 15.397×10-24cm3; (16)Surface Tension: 38.91 dyne/cm; (17)Density: 1.628 g/cm3; (18)Flash Point: 78.434 °C; (19)Enthalpy of Vaporization: 41.13 kJ/mol; (20)Boiling Point: 192.651 °C at 760 mmHg; (21)Vapour Pressure: 0.67 mmHg at 25°C.
Preparation: this chemical can be prepared by 1-(4-chloro-phenyl)-3,3-dimethyl-triazene at the temperature of 40 °C. This reaction will need reagents Bu4N(+)Cl(-), MeSO3H, Cu and solvent acetonitrile with the reaction time of 15 min. The yield is about 82%.
Uses of 4-Bromochlorobenzene: it can be used to produce 4-chloro-aniline at the ambient temperature. It will need reagent Mg and solvent diethyl ether. The yield is about 92%.
When you are using this chemical, please be cautious about it as the following:
This chemcial is irritating to eyes, respiratory system and skin. It is harmful by inhalation and if swallowed. This substance is toxic as it has a danger of very serious irreversible effects in contact with skin and if swallowed. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need to wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(Br)cc1
(2)Std. InChI: InChI=1S/C6H4BrCl/c7-5-1-3-6(8)4-2-5/h1-4H
(3)Std. InChIKey: NHDODQWIKUYWMW-UHFFFAOYSA-N
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