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82477-68-7

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Basic Information
CAS No.: 82477-68-7
Name: (3-CHLORO-5-METHOXYPHENYL)METHANOL
Article Data: 4
Molecular Structure:
Molecular Structure of 82477-68-7 ((3-CHLORO-5-METHOXYPHENYL)METHANOL)
Formula: C8H9ClO2
Molecular Weight: 172.611
Synonyms: (3-Chloro-5-methoxyphenyl)methanol;(3-chloro-5-methoxy-phenyl)methanol;
Density: 1.24 g/cm3
Boiling Point: 282.156 °C at 760 mmHg
Flash Point: 124.444 °C
PSA: 29.46000
LogP: 1.84090
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Specification

The Benzenemethanol,3-chloro-5-methoxy- has the CAS registry number 82477-68-7. This chemical's molecular formula is C8H9ClO2 and molecular weight is 172.61. What's more, its systematic name is (3-chloro-5-methoxy-phenyl)methanol. 

Physical properties of Benzenemethanol,3-chloro-5-methoxy- are: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.835; (4)ACD/LogD (pH 7.4): 1.835; (5)ACD/BCF (pH 5.5): 14.619; (6)ACD/BCF (pH 7.4): 14.619; (7)ACD/KOC (pH 5.5): 237.387; (8)ACD/KOC (pH 7.4): 237.387; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.46 Å2; (13)Index of Refraction: 1.549; (14)Molar Refractivity: 44.278 cm3; (15)Molar Volume: 139.203 cm3; (16)Polarizability: 17.553×10-24cm3; (17)Surface Tension: 41.519 dyne/cm; (18)Density: 1.24 g/cm3; (19)Flash Point: 124.444 °C; (20)Enthalpy of Vaporization: 55.029 kJ/mol; (21)Boiling Point: 282.156 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(cc(c1)Cl)CO
(2)InChI: InChI=1S/C8H9ClO2/c1-11-8-3-6(5-10)2-7(9)4-8/h2-4,10H,5H2,1H3
(3)InChIKey: OELQQMWFPQWRGF-UHFFFAOYSA-N