methyl (3S)-morpholine-3-carboxylate hydrochloride

methyl (3S)-morpholine-3-carboxylate hydrochloride

CAS: 1447972-26-0

Formula: C6H12ClNO3

SMILES: Cl.COC(=O)[C@@H]1COCCN1

IUPAC: methyl (3S)-morpholine-3-carboxylate hydrochloride

InChI: InChI=1S/C6H11NO3.ClH/c1-9-6(8)5-4-10-3-2-7-5;/h5,7H,2-4H2,1H3;1H/t5-;/m0./s1

Composition: C (39.68%), H (6.66%), Cl (19.52%), N (7.71%), O (26.43%)

Molar Mass: 181.62

Atom Count: 23

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	181.050571
Formal Charge	0
FSP3	0.83
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NSWULSIFJKMWPM-JEDNCBNOSA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.37
Topological Polar Surface Area	47.56
Polarizability	14.1
Ring Count	1
Rotatable Bond Count	2

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