CC1=CC(=NC=C1)C#N
CAS: 1620-76-4
Name: 4-methylpyridine-2-carbonitrile
SMILES: CC1=CC(=NC=C1)C#N

Molecular Processing

Molecular formula
C7H6N2
Molecular weight
118.14
Exact mass
118.0531
XLogP
1.26
TPSA
36.68
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
33.69

Supplementary Information

InChIKey: LQAWSWUFSHYCHP-UHFFFAOYSA-N
Synonyme
2-Cyano-4-methylpyridine4-Methyl-2-pyridinecarbonitrileRefChem:470647627-197-11620-76-44-methylpicolinonitrile4-methylpyridine-2-carbonitrile2-PYRIDINECARBONITRILE, 4-METHYL-MFCD001288682-CYANO-4-PICOLINE2-Cyano 4-methylpyridine2-cyano-4-methyl pyridineSCHEMBL91455SCHEMBL131627orb3023782SCHEMBL2999285SCHEMBL4756833SCHEMBL30078627LQAWSWUFSHYCHP-UHFFFAOYSA-4-methyl-pyridine-2-carbonitrileCL8875SBB055617TN9216AKOS0026656434-Methyl-2-pyridinecarbonitrile, 97%AB03610AC-5083CS-W008101PS-6146SY019192
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