[4'-(trifluoromethyl)biphenyl-4-yl]methanol supplier

Name
(4'-TRIFLUOROMETHYLBIPHENYL-4-YL)-METHANOL
EINECS
CAS No. 457889-46-2
Article Data18
CAS DataBase
Density 1.248 g/cm³
Solubility
Melting Point 147-149 °C
Formula C₁₄H₁₁F₃O
Boiling Point 332.18 °C at 760 mmHg
Molecular Weight 252.23
Flash Point 136.784 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(4'-Trifluoromethylbiphenyl-4-yl)methanol;4-(Hydroxymethyl)-4'-trifluoromethylbiphenyl;
PSA 20.23000
LogP 3.86470

[4'-(trifluoromethyl)biphenyl-4-yl]methanol Specification

This chemical is called [4'-(trifluoromethyl)biphenyl-4-yl]methanol, and its CAS registry number is 457889-46-2. With the molecular formula of C₁₄H₁₁F₃O, its molecular weight is 252.23. Additionally, its product category is Pharmacetical.

Other characteristics of the [4'-(trifluoromethyl)biphenyl-4-yl]methanol can be summarised as followings: (1)ACD/LogP: 2.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 425; (6)ACD/BCF (pH 7.4): 425; (7)ACD/KOC (pH 5.5): 2651; (8)ACD/KOC (pH 7.4): 2651; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.23 Å²; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 62.276 cm³; (15)Molar Volume: 202.045 cm³; (16)Polarizability: 24.688×10^-24cm³; (17)Surface Tension: 34.985 dyne/cm; (18)Density: 1.248 g/cm³; (19)Flash Point: 136.784 °C; (20)Enthalpy of Vaporization: 60.686 kJ/mol; (21)Boiling Point: 332.18 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OCc1ccc(cc1)c2ccc(cc2)C(F)(F)F
2.InChI: InChI=1/C14H11F3O/c15-14(16,17)13-7-5-12(6-8-13)11-3-1-10(9-18)2-4-11/h1-8,18H,9H2
3.InChIKey: YCVFDTRUBSFXSA-UHFFFAOYAP

Product Name

(4'-TRIFLUOROMETHYLBIPHENYL-4-YL)-METHANOL

[4'-(trifluoromethyl)biphenyl-4-yl]methanol Specification

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