2-(3-bromophenyl)-2-methylpropanenitrile

2-(3-bromophenyl)-2-methylpropanenitrile

CAS: 90433-20-8

Formula: C10H10BrN

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

IUPAC: 2-(3-bromophenyl)-2-methylpropanenitrile

InChI: InChI=1S/C10H10BrN/c1-10(2,7-12)8-4-3-5-9(11)6-8/h3-6H,1-2H3

Composition: C (53.60%), H (4.50%), Br (35.66%), N (6.25%)

Molar Mass: 224.101

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	222.999662
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	NKECRCMIFURWMK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.04
Topological Polar Surface Area	23.79
Polarizability	20.27
Ring Count	1
Rotatable Bond Count	1

Suppliers

OTAVA LTD.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<10 Days	90433-20-8		$162.27$162.27

MFCD11036584

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	90433-20-8		$52.79-$69.35$52.79$69.35

Chemcia Scientific, LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	90433-20-8		$85.10-$304.75$85.10$304.75