2-bromoquinoline-4-carbonitrile

2-bromoquinoline-4-carbonitrile

CAS: 95104-24-8

Formula: C10H5BrN2

SMILES: BrC1=NC2=CC=CC=C2C(=C1)C#N

IUPAC: 2-bromoquinoline-4-carbonitrile

InChI: InChI=1S/C10H5BrN2/c11-10-5-7(6-12)8-3-1-2-4-9(8)13-10/h1-5H

Composition: C (51.53%), H (2.16%), Br (34.28%), N (12.02%)

Molar Mass: 233.068

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	231.963611
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WBJXNFJBFBJGHO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.17
Topological Polar Surface Area	36.68
Polarizability	21.52
Ring Count	2
Rotatable Bond Count	0

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	95104-24-8		$582.71-$1,658.07$582.71$835.25$1,658.07