CAS No.75338-42-0,1-Ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-2-quinolinecarboxylic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	75338-42-0
Name:	1-Ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-2-quinolinecarboxylic acid
Article Data:	10

Formula:	C₁₂H₈F₃NO₃
Molecular Weight:	271.196
Synonyms:	1-Ethyl-1,4-dihydro-4-oxo-6,7,8-trifluoro-3-quinolinecarboxylicacid;1-Ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid;
EINECS:	616-213-2
Density:	1.527 g/cm³
Melting Point:	211-213 °C
Boiling Point:	401.703 °C at 760 mmHg
Flash Point:	196.743 °C
PSA:	59.30000
LogP:	2.13690

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Specification

The cas register number of 1-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid is 75338-42-0. It also can be called as 3-Quinolinecarboxylicacid, 1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo- and the Systematic name about this chemical is 1-ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid.

Physical properties about 1-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid are: (1)ACD/LogP: 0.58; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 25; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 57.61Å²; (12)Index of Refraction: 1.557; (13)Molar Refractivity: 57.139 cm³; (14)Molar Volume: 177.559 cm³; (15)Polarizability: 22.652x10^-24cm³; (16)Surface Tension: 50.076 dyne/cm; (17)Enthalpy of Vaporization: 68.835 kJ/mol.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc2c(F)c(F)c1c(C(=O)\C(=C/N1CC)C(=O)O)c2
(2)InChI: InChI=1/C12H8F3NO3/c1-2-16-4-6(12(18)19)11(17)5-3-7(13)8(14)9(15)10(5)16/h3-4H,2H2,1H3,(H,18,19)
(3)InChIKey: FKKUVCHFRDLBHN-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C12H8F3NO3/c1-2-16-4-6(12(18)19)11(17)5-3-7(13)8(14)9(15)10(5)16/h3-4H,2H2,1H3,(H,18,19)
(5)Std. InChIKey: FKKUVCHFRDLBHN-UHFFFAOYSA-N