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2-Ethylbenzyl alcohol

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Name

2-Ethylbenzyl alcohol

EINECS N/A
CAS No. 767-90-8 Density 1.00 g/cm3
PSA 20.23000 LogP 1.74130
Solubility N/A Melting Point N/A
Formula C9H12O Boiling Point 229.3 °C at 760 mmHg
Molecular Weight 136.194 Flash Point 106.1 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 767-90-8 (2-ETHYLBENZYL ALCOHOL  98) Hazard Symbols N/A
Synonyms

2-ETHYLBENZYL ALCOHOL 98

Article Data 40

2-Ethylbenzyl alcohol Synthetic route

22927-13-5

2-ethylbenzaldehyde

767-90-8

(2-ethylphenyl)methanol

Conditions
ConditionsYield
With sodium tetrahydroborate In ethanol for 4h; Reduction; Heating;99%
With sodium tetrahydroborate In ethanol at 0 - 25℃; for 2h;74%
With sodium tetrahydroborate In methanol Heating;
612-19-1

2-ethylbenzoic acid

767-90-8

(2-ethylphenyl)methanol

Conditions
ConditionsYield
With diborane In tetrahydrofuran at 0 - 20℃; for 24h;87%
With diborane In tetrahydrofuran; methanol at 0 - 20℃; for 24h;87%
Stage #1: 2-ethylbenzoic acid With boron trifluoride diethyl etherate In tetrahydrofuran at 0 - 20℃; for 24h;
Stage #2: With methanol In tetrahydrofuran for 0.75h;
87%
10602-08-1

2-ethynylbenzyl alcohol

767-90-8

(2-ethylphenyl)methanol

Conditions
ConditionsYield
With hydrogen In glycerol at 100℃; under 2250.23 Torr; for 24h; chemoselective reaction;84%
577-56-0

2-acetyl-benzoic acid

A

3453-64-3

3-methylphthalide

B

57259-71-9

1-(1-hydroxyethyl)-2-hydroxymethylbenzene

C

767-90-8

(2-ethylphenyl)methanol

Conditions
ConditionsYield
With samarium diiodide; water In tetrahydrofuran for 0.0333333h; Ambient temperature;A 41%
B 36%
C 11%
89-95-2

2-methyl-benzyl alcohol

74-88-4

methyl iodide

767-90-8

(2-ethylphenyl)methanol

Conditions
ConditionsYield
Stage #1: 2-methyl-benzyl alcohol With n-butyllithium In diethyl ether; hexane for 4h; Heating;
Stage #2: methyl iodide In diethyl ether; hexane at 20℃; for 1h;
33%
64-17-5

ethanol

908094-04-2

phenyldiazomethane

767-90-8

(2-ethylphenyl)methanol

50-00-0

formaldehyd

21450-63-5

2-ethylphenylmagnesium bromide

767-90-8

(2-ethylphenyl)methanol

Conditions
ConditionsYield
With diethyl ether
64-17-5

ethanol

10575-94-7

N-benzyl-N-nitrosobenzamide

A

120-51-4

benzoic acid benzyl ester

B

1485-70-7

N-benzylbenzamide

C

767-90-8

(2-ethylphenyl)methanol

D

65-85-0

benzoic acid

Conditions
ConditionsYield
weitere Produkten: Benzylamin,Aethylnitrit,salpetrige Saeure;
60-29-7

diethyl ether

100-39-0

benzyl bromide

orthoformic acid diethyl ester; sodium-compound

767-90-8

(2-ethylphenyl)methanol

139-02-6

sodium phenoxide

2785-29-7

benzyl potassium

80-40-0

ethyl ester of p-toluenesulfonic acid

A

767-90-8

(2-ethylphenyl)methanol

B

103-73-1

Phenetole

2-Ethylbenzyl alcohol Specification

This chemical is called (2-Ethylphenyl)methanol, and it can also be named as 2-Ethylbenzyl alcohol. With the molecular formula of C9H12O, its product categories are Alcohols; C9 to C30; Oxygen Compounds. The CAS registry number of this chemical is 767-90-8. In addition, this chemical should be sealed in the ventilated and dry place, away from light.

Other characteristics of the (2-Ethylphenyl)methanol can be summarised as followings: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.03; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 20.41; (6)ACD/BCF (pH 7.4): 20.41; (7)ACD/KOC (pH 5.5): 301.4; (8)ACD/KOC (pH 7.4): 301.4; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.533; (14)Molar Refractivity: 42.25 cm3; (15)Molar Volume: 136 cm3; (16)Polarizability: 16.75×10-24cm3; (17)Surface Tension: 37.8 dyne/cm; (18)Density: 1 g/cm3; (19)Flash Point: 106.1 °C; (20)Enthalpy of Vaporization: 49.24 kJ/mol; (21)Boiling Point: 229.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0393 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: OCc1ccccc1CC
2.InChI: InChI=1/C9H12O/c1-2-8-5-3-4-6-9(8)7-10/h3-6,10H,2,7H2,1H3
3.InChIKey: SBUIQTMDIOLKAL-UHFFFAOYAQ

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