2-Trifluoromethylquinoline supplier

Name
2-TRIFLUOROMETHYLQUINOLINE
EINECS
CAS No. 347-42-2
Article Data1
CAS DataBase
Density 1.312 g/cm³
Solubility
Melting Point 58-62℃
Formula C₁₀H₆F₃N
Boiling Point 226.41 °C at 760 mmHg
Molecular Weight 197.16
Flash Point 90.73 °C
Transport Information
Appearance
Safety 26-45-36/37-24/25
Risk Codes 25-36/37/38-20/21/22
Molecular Structure
Hazard Symbols Xi
Synonyms Quinoline,2-(trifluoromethyl);2-(trifluoromethyl)quinolone;2-(trifluoromethyl)-quinoline;2-(Trifluoromethyl)quinoline;
PSA 12.89000
LogP 3.25360

2-Trifluoromethylquinoline Specification

The Quinoline, 2-(trifluoromethyl)-, with the CAS registry number of 347-42-2, is also known as 2-Trifluoromethylquinoline. It belongs to the product categories of Quinoline Series; Heterocycles Series. This chemical's molecular formula is C₁₀H₆F₃N and molecular weight is 197.16. What's more, its IUPAC name is 2-(Trifluoromethyl)quinoline.

Physical properties about Quinoline, 2-(trifluoromethyl)- are: (1)ACD/LogP: 2.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 2.66; (5)ACD/BCF (pH 5.5): 61.42; (6)ACD/BCF (pH 7.4): 61.42; (7)ACD/KOC (pH 5.5): 663.24; (8)ACD/KOC (pH 7.4): 663.25; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.54; (14)Molar Refractivity: 47.16 cm³; (15)Molar Volume: 150.2 cm³; (16)Polarizability: 18.69×10^-24 cm³; (17)Surface Tension: 33.8 dyne/cm; (18)Density: 1.311 g/cm³; (19)Flash Point: 90.7 °C; (20)Enthalpy of Vaporization: 44.41 kJ/mol; (21)Boiling Point: 226.4 °C at 760 mmHg; (22)Vapour Pressure: 0.123 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)c1nc2ccccc2cc1
(2) InChI: InChI=1/C10H6F3N/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)14-9/h1-6H
(3) InChIKey: YZSRICFIQLVSMQ-UHFFFAOYAY

Product Name

2-TRIFLUOROMETHYLQUINOLINE

2-Trifluoromethylquinoline Specification

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