Benzeneethanol,β,4-dichloro- supplier

Name
2-CHLORO-2-(4-CHLORO-PHENYL)-ETHANOL
EINECS
CAS No. 41252-79-3
Article Data4
CAS DataBase
Density 1.328 g/cm³
Solubility
Melting Point
Formula C₈H₈Cl₂O
Boiling Point 286.5 °C at 760 mmHg
Molecular Weight 191.057
Flash Point 119.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-CHLORO-2-(4-CHLORO-PHENYL)-ETHANOL
PSA 20.23000
LogP 2.61220

Benzeneethanol,β,4-dichloro- Specification

This chemical is called Benzeneethanol,β,4-dichloro-, and its systematic name is 2-chloro-2-(4-chlorophenyl)ethanol. With the molecular formula of C₈H₈Cl₂O, its molecular weight is 191.05. The CAS registry number of the chemical is 41252-79-3.

Other characteristics of Benzeneethanol,β,4-dichloro- can be summarised as followings: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)#H bond acceptors: 1; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 20.23 Å²; (9)Index of Refraction: 1.568; (10)Molar Refractivity: 47.08 cm³; (11)Molar Volume: 143.8 cm³; (12)Polarizability: 18.66×10^-24cm³; (13)Surface Tension: 45.4 dyne/cm; (14)Density: 1.328 g/cm³; (15)Flash Point: 119.9 °C; (16)Enthalpy of Vaporization: 55.51 kJ/mol; (17)Boiling Point: 286.5 °C at 760 mmHg; (18)Vapour Pressure: 0.00123 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: ClC(CO)c1ccc(Cl)cc1
2.InChI: InChI=1/C8H8Cl2O/c9-7-3-1-6(2-4-7)8(10)5-11/h1-4,8,11H,5H2
3.InChIKey: MJAKZPPVNDXPPI-UHFFFAOYAJ
4.Std. InChI: InChI=1S/C8H8Cl2O/c9-7-3-1-6(2-4-7)8(10)5-11/h1-4,8,11H,5H2
5.Std. InChIKey: MJAKZPPVNDXPPI-UHFFFAOYSA-N

Product Name

2-CHLORO-2-(4-CHLORO-PHENYL)-ETHANOL

Benzeneethanol,β,4-dichloro- Specification

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