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2,5-Bis(trifluoromethyl)phenol

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Name

2,5-Bis(trifluoromethyl)phenol

EINECS N/A
CAS No. 779-88-4 Density 1.485 g/cm3
PSA 20.23000 LogP 3.42980
Solubility N/A Melting Point 55 °C
Formula C8H4F6O Boiling Point 185.2 °C at 760 mmHg
Molecular Weight 230.11 Flash Point 65.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 779-88-4 (2,5-BIS(TRIFLUOROMETHYL)PHENOL) Hazard Symbols N/A
Synonyms

2,5-Bis(trifluoromethyl)phenol;

 

2,5-Bis(trifluoromethyl)phenol Specification

The Phenol, 2,5-bis(trifluoromethyl)- has the CAS registry number 779-88-4. This chemical's molecular formula is C8H4F6O and molecular weight is 230.11. What's more, its systematic name is 2,5-bis(trifluoromethyl)phenol.

Physical properties of Phenol, 2,5-bis(trifluoromethyl)- are: (1)ACD/LogP: 4.61; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.406; (8)Molar Refractivity: 38.09 cm3; (9)Molar Volume: 154.8 cm3; (10)Polarizability: 15.1×10-24cm3; (11)Surface Tension: 22.3 dyne/cm; (12)Density: 1.485 g/cm3; (13)Flash Point: 65.8 °C; (14)Enthalpy of Vaporization: 43.87 kJ/mol; (15)Boiling Point: 185.2 °C at 760 mmHg; (16)Vapour Pressure: 0.515 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1ccc(cc1O)C(F)(F)F
(2)InChI: InChI=1/C8H4F6O/c9-7(10,11)4-1-2-5(6(15)3-4)8(12,13)14/h1-3,15H
(3)InChIKey: OJOPQGWFLQVKDU-UHFFFAOYAN

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