CAS No.27683-60-9,2,2-Dichloro-1-(2-chlorophenyl)-1-ethanol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	27683-60-9
Name:	2,2-Dichloro-1-(2-chlorophenyl)-1-ethanol
Article Data:	8

Formula:	C₈H₇Cl₃O
Molecular Weight:	225.502
Synonyms:	Benzylalcohol, o-chloro-a-(dichloromethyl)- (7CI,8CI);(o-Chlorophenyl)dichloromethyl carbinol;1-(2-Chlorophenyl)-2,2-dichloroethanol;2,2-Dichloro-1-(2-chlorophenyl)ethanol;benzenemethanol, 2-chloro-α-(dichloromethyl)-;2-chloro-α-(dichloromethyl)benzyl alcohol;2-Chloro-alpha-(dichloromethyl)benzyl alcohol;o-Chloro-α-(dichloromethyl)benzyl alcohol;
EINECS:	248-601-9
Density:	1.449 g/cm³
Boiling Point:	311.9 °C at 760 mmHg
Flash Point:	142.4 °C
PSA:	20.23000
LogP:	3.17710

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Specification

The 2,2-Dichloro-1-(2-chlorophenyl)-1-ethanol, with the CAS registry number 27683-60-9 and EINECS registry number 248-601-9, is also called 2-Chloro-alpha-(dichloromethyl)benzyl alcohol. And the molecular formula of the chemical is C₈H₇Cl₃O.

The characteristics of 2,2-Dichloro-1-(2-chlorophenyl)-1-ethanol are as followings: (1)ACD/LogP: 2.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.51; (4)ACD/LogD (pH 7.4): 2.51; (5)ACD/BCF (pH 5.5): 47.53; (6)ACD/BCF (pH 7.4): 47.53; (7)ACD/KOC (pH 5.5): 552.08; (8)ACD/KOC (pH 7.4): 552.07; (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: 1.581; (14)Molar Refractivity: 51.89 cm³; (15)Molar Volume: 155.6 cm³; (16)Polarizability: 20.57×10^-24cm³; (17)Surface Tension: 47.9 dyne/cm; (18)Density: 1.449 g/cm³; (19)Flash Point: 142.4 °C; (20)Enthalpy of Vaporization: 58.37 kJ/mol; (21)Boiling Point: 311.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000234 mmHg at 25°C.

Uses of 2,2-Dichloro-1-(2-chlorophenyl)-1-ethanol: It can react with chlorobenzene to produce 1,1-dichloro-2-(2-chloro-phenyl)-2-(4-chloro-phenyl)-ethane. This reaction will need reagent 3.5% oleum. The reaction time is 6 hours with temperature of 35°C, and the yield is about 71%.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1ccccc1C(O)C(Cl)Cl
(2)InChI: InChI=1/C8H7Cl3O/c9-6-4-2-1-3-5(6)7(12)8(10)11/h1-4,7-8,12H
(3)InChIKey: AYYZONLKSDKVIZ-UHFFFAOYAT