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3-Pyridinecarboxylicacid, 2,5-difluoro-

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Name

3-Pyridinecarboxylicacid, 2,5-difluoro-

EINECS N/A
CAS No. 851386-43-1 Density 1.535 g/cm3
PSA 50.19000 LogP 1.05800
Solubility N/A Melting Point 90-92 °C(Solv: chloroform (67-66-3))
Formula C6H3F2NO2 Boiling Point 277.4 °C at 760 mmHg
Molecular Weight 159.0903 Flash Point 121.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 851386-43-1 (2,5-Difluoropyridine-3-carboxylic acid) Hazard Symbols N/A
Synonyms

2,5-Difluoronicotinic acid;

 

3-Pyridinecarboxylicacid, 2,5-difluoro- Specification

The 3-Pyridinecarboxylicacid, 2,5-difluoro-, with the CAS registry number 851386-43-1, is also known as 2,5-Difluoronicotinic acid. This chemical's molecular formula is C6H3F2NO2 and molecular weight is 159.0903. What's more, its systematic name is called 2,5-Difluoropyridine-3-carboxylic acid.

Physical properties about 3-Pyridinecarboxylicacid, 2,5-difluoro- are: (1)ACD/LogP: 0.50; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 39.19 Å2; (7)Index of Refraction: 1.515; (8)Molar Refractivity: 31.26 cm3; (9)Molar Volume: 103.6 cm3; (10)Polarizability: 12.39×10-24 cm3 ; (11)Surface Tension: 51.6 dyne/cm; (12)Density: 1.535 g/cm3; (13)Flash Point: 121.6 °C; (14)Enthalpy of Vaporization: 54.5 kJ/mol; (15)Boiling Point: 277.4 °C at 760 mmHg; (16)Vapour Pressure: 0.00218 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1cc(F)cnc1F
(2) InChI: InChI=1/C6H3F2NO2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2H,(H,10,11)
(3) InChIKey: NEDDADJKOLQIJZ-UHFFFAOYAD

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