methyl (2S)-2-amino-3-cyclohexylpropanoate hydrochloride

methyl (2S)-2-amino-3-cyclohexylpropanoate hydrochloride

CAS: 17193-39-4

Formula: C10H20ClNO2

SMILES: Cl.COC(=O)[C@@H](N)CC1CCCCC1

IUPAC: methyl (2S)-2-amino-3-cyclohexylpropanoate hydrochloride

InChI: InChI=1S/C10H19NO2.ClH/c1-13-10(12)9(11)7-8-5-3-2-4-6-8;/h8-9H,2-7,11H2,1H3;1H/t9-;/m0./s1

Composition: C (54.17%), H (9.09%), Cl (15.99%), N (6.32%), O (14.43%)

Molar Mass: 221.73

Atom Count: 34

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	221.1182566
Formal Charge	0
FSP3	0.9
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YLESODBCBYZUCT-FVGYRXGTSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.94
Topological Polar Surface Area	52.32
Polarizability	20.71
Ring Count	1
Rotatable Bond Count	4

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