tert-butyl N-[(1s,4s)-4-amino-1-methylcyclohexyl]carbamate hydrochloride

tert-butyl N-[(1s,4s)-4-amino-1-methylcyclohexyl]carbamate hydrochloride

CAS: 2227199-12-2

Formula: C12H25ClN2O2

SMILES: Cl.CC(C)(C)OC(=O)N[C@]1(C)CC[C@H](N)CC1

IUPAC: tert-butyl N-[(1s,4s)-4-amino-1-methylcyclohexyl]carbamate hydrochloride

InChI: InChI=1/C12H24N2O2.ClH/c1-11(2,3)16-10(15)14-12(4)7-5-9(13)6-8-12;/h9H,5-8,13H2,1-4H3,(H,14,15);1H/t9-,12+;

Composition: C (54.43%), H (9.52%), Cl (13.39%), N (10.58%), O (12.08%)

Molar Mass: 264.79

Atom Count: 42

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	264.1604558
Formal Charge	0
FSP3	0.92
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	XPDXPOIMKCDYNY-PTJGOQBINA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.77
Topological Polar Surface Area	64.35
Polarizability	25.53
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2227199-12-2		$238.33-$4,890.16$238.33$380.82$653.20$978.54$2,934.35$4,890.16