ethyl 1-(cyanomethyl)piperidine-3-carboxylate

ethyl 1-(cyanomethyl)piperidine-3-carboxylate

CAS: 946702-02-9

Formula: C10H16N2O2

SMILES: CCOC(=O)C1CCCN(CC#N)C1

IUPAC: ethyl 1-(cyanomethyl)piperidine-3-carboxylate

InChI: InChI=1/C10H16N2O2/c1-2-14-10(13)9-4-3-6-12(8-9)7-5-11/h9H,2-4,6-8H2,1H3

Composition: C (61.20%), H (8.22%), N (14.27%), O (16.30%)

Molar Mass: 196.25

Atom Count: 30

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	196.121177763
Formal Charge	0
FSP3	0.8
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	JWAIADWIXLFQJB-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.8
Topological Polar Surface Area	53.33
Polarizability	20.57
Ring Count	1
Rotatable Bond Count	4

Suppliers

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	946702-02-9		$234.60-$936.10$234.60$936.10

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	946702-02-9		$202.14$202.14