2-amino-6-bromobenzonitrile

2-amino-6-bromobenzonitrile

CAS: 77326-62-6

Formula: C7H5BrN2

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

IUPAC: 2-amino-6-bromobenzonitrile

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

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
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZKZYTSGUONPOPF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.1
Topological Polar Surface Area	49.81
Polarizability	16.14
Ring Count	1
Rotatable Bond Count	0

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