CAS No.39652-32-9,3-CHLORO-4-METHYLBENZYL ALCOHOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	39652-32-9
Name:	3-CHLORO-4-METHYLBENZYL ALCOHOL
Article Data:	7

Formula:	C₈H₉ClO
Molecular Weight:	156.612
Synonyms:	(3-Chloro-4-methylphenyl)methanol;3-Chloro-4-methylbenzyl alcohol;
EINECS:	254-566-0
Density:	1.191 g/cm³
Boiling Point:	252.1 °C at 760 mmHg
Flash Point:	106.3 °C
Appearance:	liquid
Hazard Symbols:	Xi
Risk Codes:	36
PSA:	20.23000
LogP:	2.14070

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Specification

The Benzenemethanol,3-chloro-4-methyl-, with the CAS registry number 39652-32-9, is also known as 3-Chloro-4-methylbenzyl alcohol. It belongs to the product category of Benzhydrols, Benzyl & Special Alcohols. Its EINECS number is 254-566-0. This chemical's molecular formula is C₈H₉ClO and molecular weight is 156.61. What's more, its systematic name is (3-chloro-4-methylphenyl)methanol. It should be sealed and stored in a cool and dry place.

Physical properties of Benzenemethanol,3-chloro-4-methyl- are: (1)ACD/LogP: 2.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.09; (4)ACD/LogD (pH 7.4): 2.09; (5)ACD/BCF (pH 5.5): 22.81; (6)ACD/BCF (pH 7.4): 22.81; (7)ACD/KOC (pH 5.5): 326.45; (8)ACD/KOC (pH 7.4): 326.45; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.558; (14)Molar Refractivity: 42.42 cm³; (15)Molar Volume: 131.4 cm³; (16)Polarizability: 16.81×10^-24cm³; (17)Surface Tension: 41.8 dyne/cm; (18)Density: 1.191 g/cm³; (19)Flash Point: 106.3 °C; (20)Enthalpy of Vaporization: 51.72 kJ/mol; (21)Boiling Point: 252.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0103 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C=C(C=C1)CO)Cl
(2)InChI: InChI=1S/C8H9ClO/c1-6-2-3-7(5-10)4-8(6)9/h2-4,10H,5H2,1H3
(3)InChIKey: NLRJZTGNCBMNKS-UHFFFAOYSA-N