1-(3-bromophenyl)cyclopropane-1-carbonitrile

1-(3-bromophenyl)cyclopropane-1-carbonitrile

CAS: 124276-83-1

Formula: C10H8BrN

SMILES: BrC1=CC(=CC=C1)C1(CC1)C#N

IUPAC: 1-(3-bromophenyl)cyclopropane-1-carbonitrile

InChI: InChI=1S/C10H8BrN/c11-9-3-1-2-8(6-9)10(7-12)4-5-10/h1-3,6H,4-5H2

Composition: C (54.08%), H (3.63%), Br (35.98%), N (6.31%)

Molar Mass: 222.085

Atom Count: 20

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	220.984012
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	VHNBUFCWKWBTIZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.24
Topological Polar Surface Area	23.79
Polarizability	19.56
Ring Count	2
Rotatable Bond Count	1

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