2-(2-chloropyridin-4-yl)acetonitrile

2-(2-chloropyridin-4-yl)acetonitrile

CAS: 1000565-45-6

Formula: C7H5ClN2

SMILES: ClC1=CC(CC#N)=CC=N1

IUPAC: 2-(2-chloropyridin-4-yl)acetonitrile

InChI: InChI=1S/C7H5ClN2/c8-7-5-6(1-3-9)2-4-10-7/h2,4-5H,1H2

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	JJUUSSZGXKUHJW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.05
Topological Polar Surface Area	36.68
Polarizability	14.9
Ring Count	1
Rotatable Bond Count	1

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