2-Phenyl-4-(trifluoromethyl)-1H-imidazole supplier

Name
2-Phenyl-4-(trifluoromethyl)-1H-imidazole
EINECS
CAS No. 33469-36-2
Article Data12
CAS DataBase
Density 1.327 g/cm³
Solubility
Melting Point 212-213 °C
Formula C₁₀H₇F₃N₂
Boiling Point 336.8 °C at 760 mmHg
Molecular Weight 212.174
Flash Point 157.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Imidazole, 4-trifluoromethyl-2-phenyl-;2-Phenyl-4-(trifluoromethyl)-1H-imidazole;2-Phenyl-4-trifluoromethylimidazole;
PSA 28.68000
LogP 3.09550

2-Phenyl-4-(trifluoromethyl)-1H-imidazole Specification

This chemical is called 2-Phenyl-4-(trifluoromethyl)-1H-imidazole, and it can also be named as 1H-Imidazole,2-phenyl-5-(trifluoromethyl)-. With the CAS number of 33469-36-2, its molecular formula is C₁₀H₇F₃N₂. In addition, the molecular weight of 2-Phenyl-4-(trifluoromethyl)-1H-imidazole is 212.17.

Other characteristics of the 2-Phenyl-4-(trifluoromethyl)-1H-imidazole can be summarised as followings: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.45; (4)ACD/LogD (pH 7.4): 2.45; (5)ACD/BCF (pH 5.5): 42.6; (6)ACD/BCF (pH 7.4): 42.95; (7)ACD/KOC (pH 5.5): 509.19; (8)ACD/KOC (pH 7.4): 513.27; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.82 Å²; (13)Index of Refraction: 1.517; (14)Molar Refractivity: 48.34 cm³; (15)Molar Volume: 159.7 cm³; (16)Polarizability: 19.16×10^-24cm³; (17)Surface Tension: 36 dyne/cm; (18)Density: 1.327 g/cm³; (19)Flash Point: 157.5 °C; (20)Enthalpy of Vaporization: 55.7 kJ/mol; (21)Boiling Point: 336.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000214 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c2cnc(c1ccccc1)n2
(2)InChI: InChI=1/C10H7F3N2/c11-10(12,13)8-6-14-9(15-8)7-4-2-1-3-5-7/h1-6H,(H,14,15)
(3)InChIKey: BNLUKQUPRXZCDA-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H7F3N2/c11-10(12,13)8-6-14-9(15-8)7-4-2-1-3-5-7/h1-6H,(H,14,15)
(5)Std. InChIKey: BNLUKQUPRXZCDA-UHFFFAOYSA-N

Product Name

2-Phenyl-4-(trifluoromethyl)-1H-imidazole

2-Phenyl-4-(trifluoromethyl)-1H-imidazole Specification

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