2-(chloromethyl)pyridine-3-carbonitrile

2-(chloromethyl)pyridine-3-carbonitrile

CAS: 848774-96-9

Formula: C7H5ClN2

SMILES: ClCC1=NC=CC=C1C#N

IUPAC: 2-(chloromethyl)pyridine-3-carbonitrile

InChI: InChI=1S/C7H5ClN2/c8-4-7-6(5-9)2-1-3-10-7/h1-3H,4H2

Composition: C (55.10%), H (3.30%), Cl (23.23%), N (18.36%)

Molar Mass: 152.58

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	152.0141259
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FALRKNHUBBKYCC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.97
Topological Polar Surface Area	36.68
Polarizability	14.94
Ring Count	1
Rotatable Bond Count	1

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