2-amino-5-bromopyridine-4-carbonitrile

2-amino-5-bromopyridine-4-carbonitrile

CAS: 944401-72-3

Formula: C6H4BrN3

SMILES: NC1=NC=C(Br)C(=C1)C#N

IUPAC: 2-amino-5-bromopyridine-4-carbonitrile

InChI: InChI=1S/C6H4BrN3/c7-5-3-10-6(9)1-4(5)2-8/h1,3H,(H2,9,10)

Composition: C (36.39%), H (2.04%), Br (40.35%), N (21.22%)

Molar Mass: 198.023

Atom Count: 14

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.95886
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WEMPYBBWDHFMFG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.26
Topological Polar Surface Area	62.7
Polarizability	15.34
Ring Count	1
Rotatable Bond Count	0

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