2-bromo-N-(1-cyanocyclohexyl)acetamide

2-bromo-N-(1-cyanocyclohexyl)acetamide

Formula: C9H13BrN2O

SMILES: BrCC(=O)NC1(CCCCC1)C#N

IUPAC: 2-bromo-N-(1-cyanocyclohexyl)acetamide

InChI: InChI=1S/C9H13BrN2O/c10-6-8(13)12-9(7-11)4-2-1-3-5-9/h1-6H2,(H,12,13)

Composition: C (44.10%), H (5.35%), Br (32.60%), N (11.43%), O (6.53%)

Molar Mass: 245.12

Atom Count: 26

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	244.021126
Formal Charge	0
FSP3	0.78
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	AXZLGFGVFZAEMS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.22
Topological Polar Surface Area	52.89
Polarizability	20.47
Ring Count	1
Rotatable Bond Count	2

Suppliers

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
97%	<14 Days	C9H13BrN2O		$204.12-$306.18$204.12$306.18