Conditions | Yield |
---|---|
With tri-n-butyl-tin hydride In methanol; diethyl ether for 4h; Reduction; Heating; | 100% |
With hydrogenchloride; tetrahydrogenoboratebis(triphenylphosphine)copper(I) In dichloromethane | 94% |
With hydrogenchloride; samarium In tetrahydrofuran at 20℃; | 94% |
Conditions | Yield |
---|---|
With Methyltrichlorosilane; sodium iodide In acetonitrile at 25℃; for 9h; | A n/a B 100% |
Conditions | Yield |
---|---|
With Methyltrichlorosilane; sodium iodide In acetonitrile at 25℃; for 9h; | 100% |
Conditions | Yield |
---|---|
With [ReOCl2(1,2-bis(diphenylphosphino)ethane)]; hydrogen; potassium tetraphenylborate In toluene at 150℃; under 30003 Torr; for 30h; Autoclave; Inert atmosphere; | 99% |
With hydrogen In hexane at 250℃; under 30003 Torr; for 3h; | 96.9% |
With sodium tetrahydroborate; titanium tetrachloride In 1,2-dimethoxyethane for 14h; Ambient temperature; | 93% |
decyloxy-tetrahydro-2H-pyran
nonyl alcohol
Conditions | Yield |
---|---|
Nafion-H In methanol for 5h; | 98% |
With magnesium bromide In diethyl ether for 4h; Ambient temperature; | 95% |
non-8-en-1-ol
nonyl alcohol
Conditions | Yield |
---|---|
With formic acid; tri-tert-butyl phosphine; palladium diacetate In tetrahydrofuran at 20℃; for 12h; | 97% |
With formic acid; tri-tert-butyl phosphine; palladium diacetate In tetrahydrofuran at 20 - 60℃; for 12h; | 97% |
tert-Butyl-dimethyl-nonyloxy-silane
nonyl alcohol
Conditions | Yield |
---|---|
With hydrogen; palladium on activated charcoal In dichloromethane at 20℃; for 0.0833333h; atmospheric pressure; | 96% |
Conditions | Yield |
---|---|
With zinc borohydride; silica gel In 1,2-dimethoxyethane for 0.5h; Ambient temperature; | 95% |
With zinc borohydride; silica gel In 1,2-dimethoxyethane for 0.5h; Ambient temperature; other alkenes: regioselective anti-Markovnikov hydration; | 95% |
With zinc borohydride; silica gel In N,N-dimethyl-formamide for 0.5h; Ambient temperature; | 75% |
nonyl alcohol
Conditions | Yield |
---|---|
With hydrogen; palladium on activated charcoal In dichloromethane at 20℃; for 7h; atmospheric pressure; | 94% |
1-Methoxymethoxy-nonane
nonyl alcohol
Conditions | Yield |
---|---|
With magnesium bromide In diethyl ether for 36h; Ambient temperature; | 93% |
Conditions | Yield |
---|---|
With [iPrPN(H)P]2Fe(H)(CO)(BH4); hydrogen In toluene at 115℃; under 12654.8 Torr; for 24h; Glovebox; Sealed tube; | 91% |
With [bis({2‐[bis(propan‐2‐yl)phosphanyl]ethyl})amine](borohydride)(carbonyl)(hydride)iron(II); hydrogen at 115℃; under 12654.8 Torr; for 24h; | 91% |
With N-methylpyrrolidine zinc borohydride In tetrahydrofuran at 20℃; for 0.1h; | 90% |
1,2-epoxynonane
nonyl alcohol
Conditions | Yield |
---|---|
With zinc(II) tetrahydroborate; silica gel In tetrahydrofuran for 24h; Ambient temperature; | 88% |
Diisopropoxy-methyl-nonyl-silane
nonyl alcohol
Conditions | Yield |
---|---|
With potassium hydrogen bifluoride; dihydrogen peroxide In N,N-dimethyl-formamide at 60℃; for 6h; | 88% |
Conditions | Yield |
---|---|
With dichloro(benzene)ruthenium(II) dimer; 2-((dicyclohexylphosphino)methyl)-1-methyl-1H-imidazolin; potassium tert-butylate; hydrogen In tetrahydrofuran at 100℃; under 37503.8 Torr; for 16h; | 87% |
With zinc(II) tetrahydroborate In tetrahydrofuran at 67℃; for 5h; | 72% |
Stage #1: nonanoic acid methyl ester With iron (II) stearate; ethylenediamine In toluene at 20℃; for 0.0833333h; Inert atmosphere; Schlenk technique; Stage #2: In toluene at 100℃; for 40h; Inert atmosphere; Schlenk technique; | 55 %Chromat. |
nonylmagnesium bromide
A
dinonyl ether
B
1-Nonylselanyl-nonane
C
nonyl alcohol
Conditions | Yield |
---|---|
With selenium(IV) oxide | A 2% B 12% C 86% |
2-nonenyl alcohol
nonyl alcohol
Conditions | Yield |
---|---|
With C15H22Cl2N3O2PRu; glycerol; potassium hydroxide at 100℃; for 15h; Inert atmosphere; | 83% |
oct-1-ene
carbon monoxide
A
octane
B
2-methyloctan-1-ol
C
nonyl alcohol
Conditions | Yield |
---|---|
With dodecacarbonyl-triangulo-triruthenium; 2-(dicyclohexylphosphino)-1-methyl-1H-imidazole; water; hydrogen; lithium chloride In 1-methyl-pyrrolidin-2-one at 130℃; under 60 Torr; for 20h; Reagent/catalyst; Temperature; Concentration; Autoclave; regioselective reaction; | A 3 %Chromat. B n/a C 81% |
With dodecacarbonyl-triangulo-triruthenium; phosphoric acid; tetraethylammonium chloride; hydrogen; ethylene glycol at 140℃; for 20h; Ionic liquid; | |
With cobalt(III) oxide; hydrogen In tetrahydrofuran at 140℃; under 38787.1 Torr; for 16h; Time; Temperature; Solvent; High pressure; |
Conditions | Yield |
---|---|
With hydrido(triphenylphosphine)copper(I) hexamer; water In benzene at 80℃; for 1h; | A 77% B 3% |
allyl nonyl ether
nonyl alcohol
Conditions | Yield |
---|---|
With tetrabutylammonium tetrafluoroborate; tris(2,2'-bipyridine)nickel(II) tetrafluoroborate In N,N-dimethyl-formamide Ambient temperature; electrolysis: Mg rod anode, carbon fibre cathode, const. current 60 mA; | 77% |
Conditions | Yield |
---|---|
With 1-Phenylprop-1-yne; copper In tetrahydrofuran at 25℃; for 3h; Schlenk technique; Glovebox; | 77% |
1-Methoxymethoxy-nonane
thiophenol
A
Nonyloxymethylsulfanyl-benzene
B
nonyl alcohol
Conditions | Yield |
---|---|
With magnesium bromide In diethyl ether for 0.5h; Ambient temperature; | A 75% B 18% |
Conditions | Yield |
---|---|
With lithium aluminium tetrahydride multistep reaction, other substrates; | A 74% B 64% |
With lithium aluminium tetrahydride 1) CH2Cl2; Yield given. Multistep reaction. Yields of byproduct given; | |
With lithium aluminium tetrahydride Yield given. Multistep reaction. Yields of byproduct given; | |
With lithium aluminium tetrahydride Yield given. Multistep reaction. Yields of byproduct given; |
nonyl alcohol
Conditions | Yield |
---|---|
With hydrogen; palladium on activated charcoal In dichloromethane at 20℃; for 15h; atmospheric pressure; | 74% |
Conditions | Yield |
---|---|
With benzyltriethylammonium borohydride; chloro-trimethyl-silane In dichloromethane at 0℃; for 0.5h; | A 18% B 72% |
methylmagnesium bromide
1-(1-Methoxy-1-methylethoxy)nonane
A
1-tert-Butoxynonane
B
nonyl alcohol
Conditions | Yield |
---|---|
In diethyl ether; toluene Heating; | A 72% B 8% |
Conditions | Yield |
---|---|
With [bis(2-methylallyl)cycloocta-1,5-diene]ruthenium(II); 2-(dicyclohexylphosphanyl)-1-(2-methoxyphenyl)-1H-imidazole; hydrogen In toluene at 160℃; under 37503.8 Torr; for 24h; Autoclave; Inert atmosphere; Overall yield = 82 %Chromat.; regioselective reaction; | A n/a B 72% |
oct-1-ene
carbon monoxide
A
nonan-1-al
B
octane
C
2-methyloctan-1-ol
D
nonyl alcohol
Conditions | Yield |
---|---|
In decane at 170℃; under 45003.6 Torr; for 7h; Product distribution; Further Variations:; Reagents; Temperatures; Pressures; | A n/a B 6.6% C n/a D 66.1% |
Conditions | Yield |
---|---|
With sodium tetrahydroborate In tetrahydrofuran at 23℃; for 120h; | A 31% B 66% |
With sodium tetrahydroborate In tetrahydrofuran at 65℃; for 6h; | A 35% B 49% |
2-nonenyl alcohol
A
nonane
B
non-1-ene
C
2-nonene
D
nonyl alcohol
Conditions | Yield |
---|---|
With methanol; toluene-4-sulfonic acid at 25℃; for 5h; Reagent/catalyst; Inert atmosphere; Sealed tube; UV-irradiation; | A n/a B n/a C 65% D n/a |
(Z)-6-nonenol
A
1,9-Nonanediol
B
1,7-nonanediol
C
1,8-dihydroxynonane
D
nonyl alcohol
Conditions | Yield |
---|---|
With acetylacetonatodicarbonylrhodium(l); 1-hydroxytetraphenylcyclopentadienyl(tetraphenyl-2,4-cyclopentadien-1-one)-μ-hydrotetracarbonyldiruthenium(II); carbon monoxide; C70H72O2P2; hydrogen In 1,4-dioxane at 120℃; under 3750.38 Torr; for 36h; Inert atmosphere; Autoclave; | A 62% B n/a C n/a D 24 %Chromat. |
Conditions | Yield |
---|---|
With dicyclohexyl-carbodiimide In pyridine at 0 - 20℃; for 48h; | 100% |
3,4,6-Tri-O-acetyl-2-deoxy-2-(2,2,2-trichloroethoxycarbonylamino)-α-D-glucopyranosyl bromide
nonyl alcohol
Conditions | Yield |
---|---|
With silica gel; zinc trifluoromethanesulfonate; tetramethylurea In dichloromethane | 100% |
Conditions | Yield |
---|---|
With Amberlyst 15 In benzene for 14h; Reflux; Dean-Stark; | 100% |
Conditions | Yield |
---|---|
With [bis(2-methylallyl)cycloocta-1,5-diene]ruthenium(II); potassium tert-butylate; 1,3-dicyclohexyl-1H-imidazol-3-ium chloride In toluene at 125℃; for 24h; Schlenk technique; Inert atmosphere; Glovebox; | 99% |
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 55℃; under 760.051 Torr; for 1h; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With sulfuric acid at 80℃; for 16h; | 99% |
Conditions | Yield |
---|---|
With 4-methoxy-TEMPO; sodium hypochlorite; potassium bromide In dichloromethane; water at 0℃; for 0.05h; Mechanism; Product distribution; pH = 8.6; other primary and secondary alcohols, var. temp., time, pH, and catalytic species; | 98% |
With tert.-butylhydroperoxide In water at 60℃; for 3h; | 98% |
With 4-methoxy-TEMPO; sodium hypochlorite; potassium bromide In dichloromethane; water at 0℃; for 0.05h; pH = 8.6; | 92% |
Conditions | Yield |
---|---|
With dichloro(1,5-cyclooctadiene)ruthenium(II); C30H30N3P2(1+)*Cl(1-); potassium hydroxide In toluene at 120℃; for 24h; Inert atmosphere; Schlenk technique; | 98% |
With ruthenium trichloride; potassium hydroxide; potassium peroxomonosulphate for 12h; Ambient temperature; | 94% |
With aluminum (III) chloride; Oxone In water at 60℃; for 8h; | 93% |
Conditions | Yield |
---|---|
With copper In N,N-dimethyl-formamide at 80℃; for 8h; other time, temperature, sodium as reagent, without or other solvent;; | 98% |
With sodium hydroxide; tetra(n-butyl)ammonium hydrogensulfate In water at 25℃; | 83% |
nonyl alcohol
n-nonyl nonanoate
Conditions | Yield |
---|---|
With sodium bromate; sulfuric acid; sodium bromide In water at 20℃; for 24h; | 98% |
With [bis(2-methylallyl)cycloocta-1,5-diene]ruthenium(II); potassium tert-butylate; 1,3-dicyclohexyl-1H-imidazol-3-ium chloride In toluene at 125℃; for 24h; Schlenk technique; Inert atmosphere; Glovebox; | 97% |
With ammonium cerium(IV) nitrate; lithium bromide at 20℃; for 20h; | 91% |
Conditions | Yield |
---|---|
With N-methyl-N,N,N-trioctylammonium methylcarbonate In toluene for 1h; Reagent/catalyst; Molecular sieve; Reflux; Green chemistry; | 98% |
With lithium hexamethyldisilazane In neat (no solvent) at 0 - 20℃; for 3h; | 82% |
Conditions | Yield |
---|---|
With [RhCl2(p-cymene)]2; bis[2-(diphenylphosphino)phenyl] ether In toluene at 250℃; under 37503.8 Torr; Flow reactor; | 98% |
Conditions | Yield |
---|---|
With nanocrystalline ZSM-5 zeolite at 110℃; for 24h; Sealed tube; chemoselective reaction; | 98% |
Conditions | Yield |
---|---|
With 1-methyl-3-butylimidazolium hydrogen sulfate-impregnated propylsulfonic acid-functionalized mesoporous silica SBA-15 at 25 - 30℃; for 40h; Neat (no solvent); | 97% |
With sulfonic acid immobilized on a periodic mesoporous organosilica with an imidazolium framework In neat (no solvent) at 60℃; for 15h; Green chemistry; | 92% |
With sulfonic acid-functionalized periodic mesoporous organosilicas with ethyl bridging group at 60℃; for 24h; | 86% |
With zinc(II) oxide for 3h; Reflux; | 63% |
With molecular sieve at 120℃; for 8h; |
4-tert-butylbenzoic acid hydrazide
nonyl alcohol
Conditions | Yield |
---|---|
With [carbonylchlorohydrido{bis[2-(diphenylphosphinomethyl)ethyl]amino}ethylamino] ruthenium(II); potassium tert-butylate In toluene at 135℃; for 24h; Schlenk technique; Inert atmosphere; Green chemistry; chemoselective reaction; | 97% |
nonyl alcohol
nitric acid nonyl ester
Conditions | Yield |
---|---|
With nitric acid; urea; europium(III) trifluoromethanesulfonate In cyclohexane at 95℃; for 14h; Schlenk technique; | 96% |
With boron trifluoride; potassium nitrate In dichloromethane for 2h; Ambient temperature; | 83% |
With trichloroisocyanuric acid; silver nitrate; triphenylphosphine In acetonitrile at 82℃; for 3h; | 75% |
With sulfuric acid; nitric acid at 0℃; | |
With sulfuric acid; nitric acid |
Conditions | Yield |
---|---|
trimethylsilyl iodide In dichloromethane for 0.333333h; Ambient temperature; | 96% |
With 1,5-dichloro-9,10-anthraquinone In dichloromethane for 0.5h; UV-irradiation; | 96% |
Nafion-H In dichloromethane for 5h; | 93% |
With polystyrene-TiCl4 In dichloromethane at 20℃; for 2.08333h; Reagent/catalyst; | 93% |
With titanium tetrachloride In dichloromethane at 40℃; for 7h; Molecular sieve; | 82% |
4-hydroxy-1,3,5,5-tetramethyl-tetrahydro-pyrimidin-2-one
nonyl alcohol
Conditions | Yield |
---|---|
In 5,5-dimethyl-1,3-cyclohexadiene | 96% |
Conditions | Yield |
---|---|
With chloro-trimethyl-silane; lithium bromide In acetonitrile for 20h; Heating; | 95% |
With sulfuric acid; hydrogen bromide at 0 - 120℃; for 1h; | 90% |
With phosphorus tribromide at -4℃; for 3h; | 52% |
tert-butyl (NE)-N-[amino-(tert-butoxycarbonylamino)methylene]carbamate
nonyl alcohol
Conditions | Yield |
---|---|
With di-isopropyl azodicarboxylate; triphenylphosphine In toluene for 5h; Product distribution; Ambient temperature; var. alcohols; | 95% |
With di-isopropyl azodicarboxylate; triphenylphosphine In toluene Ambient temperature; | 95% |
Conditions | Yield |
---|---|
With di-isopropyl azodicarboxylate; triphenylphosphine In toluene for 5h; Product distribution; Ambient temperature; var. alcohols; | 95% |
With di-isopropyl azodicarboxylate; triphenylphosphine In toluene Ambient temperature; | 95% |
Conditions | Yield |
---|---|
With triethylsilane; bismuth(III) chloride In dichloromethane at 20℃; | 95% |
This chemical is called 1-Nonanol, and its systematic name is nonan-1-ol. With the molecular formula of C9H20O, its molecular weight is . The CAS registry number of this chemical is 143-08-8, and its product categories are 1-Alkanols; Monofunctional & Alpha,Omega-Bifunctional Alkanes; Monofunctional Alkanes. In additon, this chemical is colorless to slightly yellow liquid with a citrus odor similar to citronella oil, and it should be stored sealed in the cool and dry plcace.
Other characteristics of the 1-Nonanol can be summarised as followings: (1)ACD/LogP: 3.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.386; (4)ACD/LogD (pH 7.4): 3.386; (5)ACD/BCF (pH 5.5): 220.465; (6)ACD/BCF (pH 7.4): 220.465; (7)ACD/KOC (pH 5.5): 1655.651; (8)ACD/KOC (pH 7.4): 1655.651; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.432; (14)Molar Refractivity: 45.28 cm3; (15)Molar Volume: 174.602 cm3; (16)Polarizability: 17.95×10-24cm3; (17)Surface Tension: 29.509 dyne/cm; (18)Density: 0.826 g/cm3; (19)Flash Point: 97.778 °C; (20)Enthalpy of Vaporization: 52.098 kJ/mol; (21)Boiling Point: 211.617 °C at 760 mmHg; (22)Vapour Pressure: 0.041 mmHg at 25°C.
Production method of this chemical: The 1-Nonanol could be obtained by the reactant of nonanal. This reaction needs the reagent of Bu3SnH, and the solvents of methanol and diethyl ether. The yield is 100 %. In addition, this reaction should be taken for 4 hours, and the other condition is heating.
Uses of this chemical: The primary use of nonanol is in the manufacture of artificial lemon oil. Various esters of nonanol, such as nonyl acetate, are used in perfumery and flavors.
When you are using this chemical, please be cautious about it as the following: This chemical is harmful by inhalation. Do not breathe vapour. Avoid contacting with skin and eyes. It's also toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. Do not pull it into drains. Avoid releasing it to the environment. Refer to special instructions / safety data sheets when you use it.
You can still convert the following datas into molecular structure:
1.SMILES: CCCCCCCCCO
2.InChI: InChI=1/C9H20O/c1-2-3-4-5-6-7-8-9-10/h10H,2-9H2,1H3
3.InChIKey: ZWRUINPWMLAQRD-UHFFFAOYAC
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mammal (species unspecified) | LC50 | inhalation | 4360mg/m3 (4360mg/m3) | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(5), Pg. 61, 1986. | |
mammal (species unspecified) | LD50 | unreported | 19gm/kg (19000mg/kg) | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(5), Pg. 61, 1986. | |
mouse | LC50 | inhalation | 5500mg/m3/2H (5500mg/m3) | "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 94, 1982. | |
mouse | LD50 | intraperitoneal | 800mg/kg (800mg/kg) | "Patty's Industrial Hygiene and Toxicology," 3rd rev. ed., Clayton, G.D., and F.E. Clayton, eds., New York, John Wiley & Sons, Inc., 1978-82. Vol. 3 originally pub. in 1979; pub. as 2n rev. ed. in 1985.Vol. 2C, Pg. 4628, 1982. | |
mouse | LD50 | oral | 6400mg/kg (6400mg/kg) | "Patty's Industrial Hygiene and Toxicology," 3rd rev. ed., Clayton, G.D., and F.E. Clayton, eds., New York, John Wiley & Sons, Inc., 1978-82. Vol. 3 originally pub. in 1979; pub. as 2n rev. ed. in 1985.Vol. 2C, Pg. 4628, 1982. | |
rabbit | LD50 | skin | 5660uL/kg (5.66mL/kg) | Food and Cosmetics Toxicology. Vol. 11, Pg. 95, 1973. Link to PubMed | |
rat | LD50 | intraperitoneal | 800mg/kg (800mg/kg) | "Patty's Industrial Hygiene and Toxicology," 3rd rev. ed., Clayton, G.D., and F.E. Clayton, eds., New York, John Wiley & Sons, Inc., 1978-82. Vol. 3 originally pub. in 1979; pub. as 2n rev. ed. in 1985.Vol. 2C, Pg. 4628, 1982. | |
rat | LD50 | oral | 3560mg/kg (3560mg/kg) | Food and Cosmetics Toxicology. Vol. 11, Pg. 95, 1973. Link to PubMed |
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