6-chloro-2-methoxypyridine-3-carbonitrile

6-chloro-2-methoxypyridine-3-carbonitrile

CAS: 121643-46-7

Formula: C7H5ClN2O

SMILES: COC1=NC(Cl)=CC=C1C#N

IUPAC: 6-chloro-2-methoxypyridine-3-carbonitrile

InChI: InChI=1S/C7H5ClN2O/c1-11-7-5(4-9)2-3-6(8)10-7/h2-3H,1H3

Composition: C (49.87%), H (2.99%), Cl (21.03%), N (16.62%), O (9.49%)

Molar Mass: 168.58

Atom Count: 16

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	168.0090405
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	BXDPLINBPHQTHU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.27
Topological Polar Surface Area	45.91
Polarizability	15.77
Ring Count	1
Rotatable Bond Count	1

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