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5-methoxypyridine-3-carbonitrile

5-methoxypyridine-3-carbonitrile

CAS: 298204-74-7

Formula: C7H6N2O

SMILES: COC1=CN=CC(=C1)C#N

IUPAC: 5-methoxypyridine-3-carbonitrile

InChI: InChI=1S/C7H6N2O/c1-10-7-2-6(3-8)4-9-5-7/h2,4-5H,1H3

Composition: C (62.68%), H (4.51%), N (20.88%), O (11.93%)

Molar Mass: 134.138

Atom Count: 16

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 134.048012821
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey DMLPQTWDFZCDTJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.09
Topological Polar Surface Area 45.91
Polarizability 13.79
Ring Count 1
Rotatable Bond Count 1

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