ethyl 2-oxa-5-azabicyclo[2.2.2]octane-4-carboxylate hydrochloride

ethyl 2-oxa-5-azabicyclo[2.2.2]octane-4-carboxylate hydrochloride

CAS: 2387534-75-8

Formula: C9H16ClNO3

SMILES: Cl.CCOC(=O)C12CCC(CN1)OC2

IUPAC: ethyl 2-oxa-5-azabicyclo[2.2.2]octane-4-carboxylate hydrochloride

InChI: InChI=1/C9H15NO3.ClH/c1-2-12-8(11)9-4-3-7(5-10-9)13-6-9;/h7,10H,2-6H2,1H3;1H

Composition: C (48.76%), H (7.28%), Cl (15.99%), N (6.32%), O (21.65%)

Molar Mass: 221.68

Atom Count: 30

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	221.0818711
Formal Charge	0
FSP3	0.89
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PIUFSCPEBSBFLG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.29
Topological Polar Surface Area	47.56
Polarizability	18.87
Ring Count	2
Rotatable Bond Count	3

Suppliers

J&W PHARMLAB LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	2387534-75-8		$316.25-$3,312.00$316.25$516.35$916.55$1,713.50$3,312.00$10,338.50