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58622-59-6

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Basic Information
CAS No.: 58622-59-6
Name: Benzeneacetonitrile, 3-chloro-4-hydroxy-
Article Data: 1
Molecular Structure:
Molecular Structure of 58622-59-6 (Benzeneacetonitrile, 3-chloro-4-hydroxy-)
Formula: C8H6ClNO
Molecular Weight: 167.59
Synonyms: 3-Chloro-4-hydroxybenzeneacetonitrile;2-(3-chloro-4-hydroxyphenyl)acetonitrile;
Density: 1.332 g/cm3
Boiling Point: 324.16 °C at 760 mmHg
Flash Point: 149.847 °C
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    Benzeneacetonitrile, 3-chloro-4-hydroxy-

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    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemicals. W

    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, s

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  • 2-Cyclohexen-1-ol,6-methyl-3-(1-methylethyl)-

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  • 3-Chloro-4-hydroxybenzeneacetonitrile

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    3-Chloro-4-hydroxybenzeneacetonitrile

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    We are committed to providing our customers with the best products and services at the most competitive prices.Appearance:white crystalline powder Storage:Room temperature with sealed well Package:according to the clients requirement Application:Use

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Specification

The CAS register number of 3-Chloro-4-hydroxybenzeneacetonitrile is 58622-59-6. It also can be called as 2-(3-chloro-4-hydroxyphenyl)acetonitrile and the systematic name about this chemical is (2R)-(4-chlorophenyl)(hydroxy)ethanenitrile. The molecular formula about this chemical is C8H6ClNO and the molecular weight is 167.59.

Physical properties about 3-Chloro-4-hydroxybenzeneacetonitrile are: (1)ACD/LogP: 1.59; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 44.02Å2; (6)Index of Refraction: 1.585; (7)Molar Refractivity: 42.148 cm3; (8)Molar Volume: 125.839 cm3; (9)Polarizability: 16.709x10-24cm3; (10)Surface Tension: 55.473 dyne/cm; (11)Enthalpy of Vaporization: 59.767 kJ/mol; (12)Boiling Point: 324.16 °C at 760 mmHg.

Uses of 3-Chloro-4-hydroxybenzeneacetonitrile: it can be used to produce C10H12ClNO2*ClH at temperature of 4 ℃. This reaction will need reagent HCl-gas and solvent ethanol with reaction time of 72 hours. The yield is about 93%.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)[C@@H](O)C#N
(2)InChI: InChI=1/C8H6ClNO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,8,11H/t8-/m0/s1
(3)InChIKey: LSDSHEPNJSMUTI-QMMMGPOBBB
(4)Std. InChI: InChI=1S/C8H6ClNO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,8,11H/t8-/m0/s1
(5)Std. InChIKey: LSDSHEPNJSMUTI-QMMMGPOBSA-N