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CAS No.: | 325-14-4 |
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Name: | 7-(TRIFLUOROMETHYL)QUINOLINE |
Molecular Structure: | |
Formula: | C10H6F3N |
Molecular Weight: | 197.16 |
Synonyms: | 7-Trrfluoromethylquinoline |
Density: | 1.311 g/cm3 |
Melting Point: | 65-67 °C |
Boiling Point: | 243.7 °C at 760 mmHg |
Flash Point: | 101.2 °C |
Hazard Symbols: | Xi |
PSA: | 12.89000 |
LogP: | 3.25360 |
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The CAS register number of Quinoline,7-(trifluoromethyl)- is 325-14-4. It also can be called as 7-Trifluoromethylquinoline and the systematic name about this chemical is 7-(trifluoromethyl)quinoline. The molecular formula about this chemical is C10H6F3N and the molecular weight is 197.16. It belongs to the following product categories which include Quinoline & Isoquinoline; Miscellaneous and so on.
Physical properties about Quinoline,7-(trifluoromethyl)- are: (1)ACD/LogP: 3.02; (2)ACD/LogD (pH 5.5): 3.02; (3)ACD/LogD (pH 7.4): 3.02; (4)ACD/BCF (pH 5.5): 116.07; (5)ACD/BCF (pH 7.4): 116.2; (6)ACD/KOC (pH 5.5): 1045.66; (7)ACD/KOC (pH 7.4): 1046.82; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89Å2; (10)Index of Refraction: 1.54; (11)Molar Refractivity: 47.16 cm3; (12)Molar Volume: 150.2 cm3; (13)Polarizability: 18.69x10-24cm3; (14)Surface Tension: 33.8 dyne/cm; (15)Flash Point: 101.2 °C; (16)Enthalpy of Vaporization: 46.13 kJ/mol; (17)Boiling Point: 243.7 °C at 760 mmHg; (18)Vapour Pressure: 0.0494 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc2ncccc2cc1
(2)InChI: InChI=1/C10H6F3N/c11-10(12,13)8-4-3-7-2-1-5-14-9(7)6-8/h1-6H
(3)InChIKey: CMMSEFHVUYEEDY-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C10H6F3N/c11-10(12,13)8-4-3-7-2-1-5-14-9(7)6-8/h1-6H
(5)Std. InChIKey: CMMSEFHVUYEEDY-UHFFFAOYSA-N