CAS No.155377-05-2,6-Trifluoromethyl-pyridine-2-carboxylic acid methyl ester Suppliers

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Basic Information

Molecular Structure:
CAS No.:	155377-05-2
Name:	6-Trifluoromethyl-pyridine-2-carboxylic acid methyl ester
Article Data:	32

Formula:	C₈H₆F₃NO₂
Molecular Weight:	205.136
Synonyms:	Methyl 6-(trifluoromethyl)pyridine-2-carboxylate;Methyl 2-(trifluoromethyl)-6-pyridinecarboxylate;Methyl 6-(trifluoromethyl)picolinate;
Density:	1.331 g/cm³
Boiling Point:	232.6 °C at 760 mmHg
Flash Point:	94.5 °C
PSA:	39.19000
LogP:	1.88700

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Specification

The 2-Pyridinecarboxylicacid, 6-(trifluoromethyl)-, methyl ester, with the CAS registry number 155377-05-2, is also known as Methyl 2-(trifluoromethyl)-6-pyridinecarboxylate. This chemical's molecular formula is C₈H₆F₃NO₂ and molecular weight is 205.13. What's more, its systematic name is methyl 6-(trifluoromethyl)pyridine-2-carboxylate.

Physical properties of 2-Pyridinecarboxylicacid, 6-(trifluoromethyl)-, methyl ester are: (1)ACD/LogP: 1.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.56; (4)ACD/LogD (pH 7.4): 1.56; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 39.19 Å²; (9)Index of Refraction: 1.446; (10)Molar Refractivity: 41.09 cm³; (11)Molar Volume: 154 cm³; (12)Polarizability: 16.29×10^-24cm³; (13)Surface Tension: 30.9 dyne/cm; (14)Density: 1.331 g/cm³; (15)Flash Point: 94.5 °C; (16)Enthalpy of Vaporization: 46.93 kJ/mol; (17)Boiling Point: 232.6 °C at 760 mmHg; (18)Vapour Pressure: 0.0584 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cccc(n1)C(=O)OC
(2)InChI: InChI=1S/C8H6F3NO2/c1-14-7(13)5-3-2-4-6(12-5)8(9,10)11/h2-4H,1H3
(3)InChIKey: AYABEJGGSWJVPN-UHFFFAOYSA-N