2-[4-(bromomethyl)phenyl]-2-methylpropanenitrile

2-[4-(bromomethyl)phenyl]-2-methylpropanenitrile

CAS: 1201643-73-3

Formula: C11H12BrN

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

IUPAC: 2-[4-(bromomethyl)phenyl]-2-methylpropanenitrile

InChI: InChI=1S/C11H12BrN/c1-11(2,8-13)10-5-3-9(7-12)4-6-10/h3-6H,7H2,1-2H3

Composition: C (55.48%), H (5.08%), Br (33.56%), N (5.88%)

Molar Mass: 238.128

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	237.015312
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	VSTXAWAMUHWZBE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.27
Topological Polar Surface Area	23.79
Polarizability	22
Ring Count	1
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	1201643-73-3		$106.61-$159.39$106.61$159.39

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<6 Days	1201643-73-3		$86.25-$303.60$86.25$303.60

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1201643-73-3		$99.62-$369.47$99.62$223.20$369.47