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3-Pyridinecarbonitrile,2-methyl- (1721-23-9)

Identification
Name:3-Pyridinecarbonitrile,2-methyl-
Synonyms:Nicotinonitrile,2-methyl- (6CI,7CI,8CI);2-Methyl-3-cyanopyridine;3-Cyano-2-methylpyridine;3-Cyano-2-picoline;
CAS:1721-23-9
Molecular Formula: C7H6N2
Molecular Weight: 118.14
InChI: InChI=1/C7H6N2/c1-6-7(5-8)3-2-4-9-6/h2-4H,1H3
Molecular Structure: (C7H6N2) Nicotinonitrile,2-methyl- (6CI,7CI,8CI);2-Methyl-3-cyanopyridine;3-Cyano-2-methylpyridine;3-Cyano-2-...
Properties
Density:1.08 g/cm3
Refractive index:1.531
Water Solubility:at 25 deg C (mg/L): 9457
Solubility:at 25 deg C (mg/L): 9457
Specification:

The 3-Cyano-2-methylpyridine with the CAS number 1721-23-9 is also called 3-Pyridinecarbonitrile,2-methyl-. The systematic name is 2-methylpyridine-3-carbonitrile. Its molecular formula is C7H6N2. The product category is Pyridines. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 3-Cyano-2-methylpyridine are: (1)ACD/LogP: 0.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.96; (4)ACD/LogD (pH 7.4): 0.96; (5)ACD/BCF (pH 5.5): 3.17; (6)ACD/BCF (pH 7.4): 3.18; (7)ACD/KOC (pH 5.5): 79.55; (8)ACD/KOC (pH 7.4): 79.63; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 36.68 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 33.74 cm3; (15)Molar Volume: 108.9 cm3; (16)Polarizability: 13.37×10-24cm3; (17)Surface Tension: 47.9 dyne/cm; (18)Enthalpy of Vaporization: 44.66 kJ/mol; (19)Vapour Pressure: 0.194 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1cccnc1C
(2)InChI: InChI=1/C7H6N2/c1-6-7(5-8)3-2-4-9-6/h2-4H,1H3
(3)InChIKey: UBKKNWJGYLSDSJ-UHFFFAOYAZ

Safety Data