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917251-86-6

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Basic Information
CAS No.: 917251-86-6
Name: 8-Bromo-3-(trifluoromethyl)quinoline
Molecular Structure:
Molecular Structure of 917251-86-6 (8-Bromo-3-(trifluoromethyl)quinoline)
Formula: C10H5BrF3N
Molecular Weight: 276.0526
Synonyms: Quinoline, 8-bromo-3-(trifluoromethyl)-;
Density: 1.658 g/cm3
Boiling Point: 301.343 °C at 760 mmHg
Flash Point: 136.048 °C
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Specification

The 8-Bromo-3-(trifluoromethyl)quinoline, with the CAS registry number 917251-86-6, is also known as Quinoline, 8-bromo-3-(trifluoromethyl)-. This chemical's molecular formula is C10H5BrF3N and molecular weight is 276.0526. Its systematic name is called 8-bromo-3-(trifluoromethyl)quinoline.

Physical properties of 8-Bromo-3-(trifluoromethyl)quinoline: (1)ACD/LogP: 3.19; (2)ACD/LogD (pH 5.5): 3.188; (3)ACD/LogD (pH 7.4): 3.188; (4)ACD/BCF (pH 5.5): 155.971; (5)ACD/BCF (pH 7.4): 155.971; (6)ACD/KOC (pH 5.5): 1292.374; (7)ACD/KOC (pH 7.4): 1292.378; (8)#H bond acceptors: 1; (9)Index of Refraction: 1.573; (10)Molar Refractivity: 54.857 cm3; (11)Molar Volume: 166.468 cm3; (12)Surface Tension: 37.87 dyne/cm; (13)Density: 1.658 g/cm3; (14)Flash Point: 136.048 °C; (15)Enthalpy of Vaporization: 51.983 kJ/mol; (16)Boiling Point: 301.343 °C at 760 mmHg; (17)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2cc(cnc2c(c1)Br)C(F)(F)F
(2)InChI: InChI=1/C10H5BrF3N/c11-8-3-1-2-6-4-7(10(12,13)14)5-15-9(6)8/h1-5H
(3)InChIKey: AQBADHOMRVAOTB-UHFFFAOYAG