3,6-dimethylpyridine-2-carbonitrile

3,6-dimethylpyridine-2-carbonitrile

CAS: 68164-77-2

Formula: C8H8N2

SMILES: CC1=CC=C(C)C(=N1)C#N

IUPAC: 3,6-dimethylpyridine-2-carbonitrile

InChI: InChI=1S/C8H8N2/c1-6-3-4-7(2)10-8(6)5-9/h3-4H,1-2H3

Composition: C (72.70%), H (6.10%), N (21.20%)

Molar Mass: 132.166

Atom Count: 18

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	132.068748266
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CWZCKTXCBOLZIG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.88
Topological Polar Surface Area	36.68
Polarizability	14.8
Ring Count	1
Rotatable Bond Count	0

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