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methyl DL-prolinate hydrochloride

methyl DL-prolinate hydrochloride

CAS: 79397-50-5

Formula: C6H12ClNO2

SMILES: Cl[H].COC(=O)C1CCCN1

IUPAC: methyl pyrrolidine-2-carboxylate hydrochloride

InChI: InChI=1/C6H11NO2.ClH/c1-9-6(8)5-3-2-4-7-5;/h5,7H,2-4H2,1H3;1H

Composition: C (43.51%), H (7.30%), Cl (21.40%), N (8.46%), O (19.32%)

Molar Mass: 165.62

Atom Count: 22

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 165.0556563
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HQEIPVHJHZTMDP-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 32.83
Topological Polar Surface Area 38.33
Polarizability 13.36
Ring Count 1
Rotatable Bond Count 2

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