3-Pyridinecarbonitrile,2-fluoro-6-methyl- supplier

Name
3-CYANO-2-FLUORO-6-PICOLINE
EINECS
CAS No. 54957-80-1
Density 1.19 g/cm³
Solubility
Melting Point
Formula C₇H₅FN₂
Boiling Point 235.3 °C at 760 mmHg
Molecular Weight 136.13
Flash Point 96.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols T
Synonyms 2-fluoro-6-methyl-pyridine-3-carbonitrile;3-pyridinecarbonitrile, 2-fluoro-6-methyl-;2-fluoro-6-methylpyridine-3-carbonitrile;3-Cyano-2-fluoro-6-methylpyridine;3-Cyano-2-fluoro-6-picoline;3-Cyano-2-Fluoro-6-Picoline3-Cyano-2-Fluoro-6-Methyl Pyridine;
PSA 36.68000
LogP 1.40078

3-Pyridinecarbonitrile,2-fluoro-6-methyl- Specification

The 3-Pyridinecarbonitrile,2-fluoro-6-methyl-, with the CAS registry number 54957-80-1, has the systematic name of 2-fluoro-6-methyl-pyridine-3-carbonitrile. It belongs to the product category of Pyridines. And the molecular formula of the chemical is C₇H₅FN₂.

The characteristics of 3-Pyridinecarbonitrile,2-fluoro-6-methyl- are as followings: (1)ACD/LogP: 0.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.88; (4)ACD/LogD (pH 7.4): 0.88; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 36.68 Å²; (9)Index of Refraction: 1.506; (10)Molar Refractivity: 33.85 cm³; (11)Molar Volume: 113.8 cm³; (12)Polarizability: 13.42×10^-24cm³; (13)Surface Tension: 44.5 dyne/cm; (14)Density: 1.19 g/cm³; (15)Flash Point: 96.1 °C; (16)Enthalpy of Vaporization: 47.21 kJ/mol; (17)Boiling Point: 235.3 °C at 760 mmHg; (18)Vapour Pressure: 0.0503 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1ccc(c(n1)F)C#N
(2)InChI: InChI=1/C7H5FN2/c1-5-2-3-6(4-9)7(8)10-5/h2-3H,1H3
(3)InChIKey: YHGWMSLBTCAHJR-UHFFFAOYAS

Product Name

3-CYANO-2-FLUORO-6-PICOLINE

3-Pyridinecarbonitrile,2-fluoro-6-methyl- Specification

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