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2-(2-Bromophenyl)ethanol

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Name

2-(2-Bromophenyl)ethanol

EINECS N/A
CAS No. 1074-16-4 Density 1.479 g/cm3
PSA 20.23000 LogP 1.98390
Solubility N/A Melting Point N/A
Formula C8H9BrO Boiling Point 269.3 °C at 760 mmHg
Molecular Weight 201.063 Flash Point 116.7 °C
Transport Information N/A Appearance clear slightly yellow liquid
Safety 24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 1074-16-4 (2-BROMOPHENETHYLALCOHOL) Hazard Symbols N/A
Synonyms

Phenethylalcohol, o-bromo- (7CI,8CI);2-(2-Hydroxyethyl)bromobenzene;2-Bromobenzeneethanol;2-Bromophenethyl alcohol;o-Bromophenethyl alcohol;o-Bromophenylethyl alcohol;

Article Data 35

2-(2-Bromophenyl)ethanol Specification

The IUPAC name of this chemical is 2-(2-Bromophenyl)ethanol. With the CAS registry number 1074-16-4, it is also named as benzeneethanol,2-bromo-. In addition, the molecular formula is C8H9BrO and the molecular weight is 201.06. It is a kind of clear slightly yellow liquid and should be stored in a cool and dry place.

Physical properties about this chemical are: (1)ACD/LogP: 2.13; (2)ACD/LogD (pH 5.5): 2.13; (3)ACD/LogD (pH 7.4): 2.13; (4)ACD/BCF (pH 5.5): 24.51; (5)ACD/BCF (pH 7.4): 24.51; (6)ACD/KOC (pH 5.5): 343.65; (7)ACD/KOC (pH 7.4): 343.65; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 9.23 Å2; (12)Index of Refraction: 1.576; (13)Molar Refractivity: 45.02 cm3; (14)Molar Volume: 135.9 cm3; (15)Polarizability: 17.85 ×10-24cm3; (16)Surface Tension: 44.4 dyne/cm; (17)Density: 1.479 g/cm3; (18)Flash Point: 116.7 °C; (19)Enthalpy of Vaporization: 53.61 kJ/mol; (20)Boiling Point: 269.3 °C at 760 mmHg; (21)Vapour Pressure: 0.0036 mmHg at 25°C.

Preparation of 2-(2-Bromophenyl)ethanol: it can be prepared by (2-bromo-phenyl)-acetic acid. This reaction is a reduction reaction. It will need reagent LiAlH4 and solvent tetrahydrofuran. The reaction time is 18 hours by heating. The yield is about 86%.

2-(2-Bromophenyl)ethanol can be prepared by (2-bromo-phenyl)-acetic acid.

Uses of 2-(2-Bromophenyl)ethanol: it can be used to get 1-bromo-2-(2-bromo-ethyl)-benzene. This reaction will need reagents 48 percent HBr and H2SO4. The reaction time is 3 hours by heating. The yield is about 72%.

2-(2-Bromophenyl)ethanol can be used to get 1-bromo-2-(2-bromo-ethyl)-benzene

When you are using this chemical, please be cautious about it as the following:
During using it, you should avoid contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccccc1CCO
(2)Std.InChI: InChI=1S/C8H9BrO/c9-8-4-2-1-3-7(8)5-6-10/h1-4,10H,5-6H2
(3)Std.InChIKey: ADLOWZRDUHSVRU-UHFFFAOYSA-N

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