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2,6-Difluoro-4-hydroxybenzyl alcohol

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Name

2,6-Difluoro-4-hydroxybenzyl alcohol

EINECS N/A
CAS No. 438049-36-6 Density 1.454 g/cm3
PSA 40.46000 LogP 1.16270
Solubility N/A Melting Point N/A
Formula C7H6F2O2 Boiling Point 286.004 °C at 760 mmHg
Molecular Weight 160.1181464 Flash Point 771 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 438049-36-6 (Benzenemethanol, 2,6-difluoro-4-hydroxy- (9CI)) Hazard Symbols N/A
Synonyms

2,6-Difluoro-4-hydroxybenzyl alcohol;

 

2,6-Difluoro-4-hydroxybenzyl alcohol Specification

The Benzenemethanol, 2, 6-difluoro-4-hydroxy-, with the CAS registry number 438049-36-6, is also known as 2, 6-Difluoro-4-hydroxybenzyl alcohol. It belongs to the product categories of Halide; Alcohol. This chemical's molecular formula is C7H6F2O2 and molecular weight is 160.1181464. What's more, its systematic name is 3, 5-Difluoro-4-(hydroxymethyl)phenol.

Physical properties about Benzenemethanol, 2, 6-difluoro-4-hydroxy- are: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 5; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 111; (8)ACD/KOC (pH 7.4): 81; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 40.46 Å2; (13)Index of Refraction: 1.541; (14)Molar Refractivity: 34.573 cm3; (15)Molar Volume: 110.099 cm3; (16)Polarizability: 13.706×10-24 cm3; (17)Surface Tension: 48.186 dyne/cm; (18)Density: 1.454 g/cm3; (19)Flash Point: 126.771 °C; (20)Enthalpy of Vaporization: 55.458 kJ/mol; (21)Boiling Point: 286.004 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cc(O)cc(F)c1CO
(2) InChI: InChI=1/C7H6F2O2/c8-6-1-4(11)2-7(9)5(6)3-10/h1-2,10-11H,3H2
(3) InChIKey: RQMJWCOEDWMJLS-UHFFFAOYAS

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