2-(bromomethyl)pyridine-4-carbonitrile

2-(bromomethyl)pyridine-4-carbonitrile

CAS: 597563-02-5

Formula: C7H5BrN2

SMILES: BrCC1=NC=CC(=C1)C#N

IUPAC: 2-(bromomethyl)pyridine-4-carbonitrile

InChI: InChI=1S/C7H5BrN2/c8-4-7-3-6(5-9)1-2-10-7/h1-3H,4H2

Composition: C (42.67%), H (2.56%), Br (40.55%), N (14.22%)

Molar Mass: 197.035

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	195.963611
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	GCNZQCMSCTYHEO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.95
Topological Polar Surface Area	36.68
Polarizability	15.87
Ring Count	1
Rotatable Bond Count	1

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