CAS No.756520-66-8,1-(2,6-Dichloro-3-fluorophenyl)ethanol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	756520-66-8
Name:	1-(2,6-Dichloro-3-fluorophenyl)ethanol
Article Data:	35

Formula:	C₈H₇Cl₂FO
Molecular Weight:	209.047
Synonyms:	Benzenemethanol, 2,6-dichloro-3-fluoro-α-methyl-;1-(2,6-Dichloro-3-fluorophenyl)ethan-1-ol;2,6-Dichloro-3-fluoro-α-methylbenzenemethanol;
Density:	1.407 g/cm³
Boiling Point:	261.329 °C at 760 mmHg
Flash Point:	111.848 °C
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	20.23000
LogP:	3.18580

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Specification

1-(2,6-Dichloro-3-fluorophenyl)ethanol is an organic compound with the formula C₈H₇Cl₂FO, and its systematic name is the same with the product name. With the CAS registry number 756520-66-8, it is also named as 2,6-Dichloro-3-fluoro-α-methylbenzenemethanol. In addition, the molecular weight is 209.04.

Physical properties of 1-(2,6-Dichloro-3-fluorophenyl)ethanol are: (1)ACD/LogP: 2.696; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.70; (4)ACD/LogD (pH 7.4): 2.70; (5)ACD/BCF (pH 5.5): 65.86; (6)ACD/BCF (pH 7.4): 65.86; (7)ACD/KOC (pH 5.5): 697.24; (8)ACD/KOC (pH 7.4): 697.24; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.23 Å²; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 47.124 cm³; (15)Molar Volume: 148.616 cm³; (16)Polarizability: 18.681×10^-24cm³; (17)Surface Tension: 41.91 dyne/cm; (18)Density: 1.407 g/cm³; (19)Flash Point: 111.848 °C; (20)Enthalpy of Vaporization: 52.726 kJ/mol; (21)Boiling Point: 261.329 °C at 760 mmHg; (22)Vapour Pressure: 0.006 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(F)c(Cl)c1C(C)O
(2)Std. InChI: InChI=1S/C8H7Cl2FO/c1-4(12)7-5(9)2-3-6(11)8(7)10/h2-4,12H,1H3
(3)Std. InChIKey: JAOYKRSASYNDGH-UHFFFAOYSA-N