4-bromo-3-chlorobenzonitrile

4-bromo-3-chlorobenzonitrile

CAS: 57418-97-0

Formula: C7H3BrClN

SMILES: ClC1=CC(=CC=C1Br)C#N

IUPAC: 4-bromo-3-chlorobenzonitrile

InChI: InChI=1S/C7H3BrClN/c8-6-2-1-5(4-10)3-7(6)9/h1-3H

Composition: C (38.84%), H (1.40%), Br (36.91%), Cl (16.38%), N (6.47%)

Molar Mass: 216.46

Atom Count: 13

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.91374
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	YWTKUWXYQQZSIL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.21
Topological Polar Surface Area	23.79
Polarizability	16.95
Ring Count	1
Rotatable Bond Count	0

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