ethyl (1S,3R)-3-aminocyclohexane-1-carboxylate hydrochloride

ethyl (1S,3R)-3-aminocyclohexane-1-carboxylate hydrochloride

CAS: 33073-64-2

Formula: C9H18ClNO2

SMILES: Cl.CCOC(=O)[C@H]1CCC[C@@H](N)C1

IUPAC: ethyl (1S,3R)-3-aminocyclohexane-1-carboxylate hydrochloride

InChI: InChI=1S/C9H17NO2.ClH/c1-2-12-9(11)7-4-3-5-8(10)6-7;/h7-8H,2-6,10H2,1H3;1H/t7-,8+;/m0./s1

Composition: C (52.05%), H (8.74%), Cl (17.07%), N (6.74%), O (15.41%)

Molar Mass: 207.7

Atom Count: 31

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	207.1026065
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MLDUTPQKFFVCJJ-KZYPOYLOSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.69
Topological Polar Surface Area	52.32
Polarizability	18.87
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	33073-64-2		$157.55-$3,185.50$157.55$201.25$286.35$458.85$802.70$3,185.50