methyl 2-[(3S)-pyrrolidin-3-yl]acetate hydrochloride

methyl 2-[(3S)-pyrrolidin-3-yl]acetate hydrochloride

CAS: 1024038-33-2

Formula: C7H14ClNO2

SMILES: Cl.COC(=O)C[C@@H]1CCNC1

IUPAC: methyl 2-[(3S)-pyrrolidin-3-yl]acetate hydrochloride

InChI: InChI=1S/C7H13NO2.ClH/c1-10-7(9)4-6-2-3-8-5-6;/h6,8H,2-5H2,1H3;1H/t6-;/m0./s1

Composition: C (46.80%), H (7.86%), Cl (19.73%), N (7.80%), O (17.81%)

Molar Mass: 179.64

Atom Count: 25

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	179.0713064
Formal Charge	0
FSP3	0.86
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZDVXNHFLFAPGGA-RGMNGODLSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.74
Topological Polar Surface Area	38.33
Polarizability	15.2
Ring Count	1
Rotatable Bond Count	3

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