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(2S,4R)-4-phenylpyrrolidine-2-carboxylic acid hydrochloride

(2S,4R)-4-phenylpyrrolidine-2-carboxylic acid hydrochloride

CAS: 82087-67-0

Formula: C11H14ClNO2

SMILES: Cl.OC(=O)[C@@H]1C[C@@H](CN1)C1=CC=CC=C1

IUPAC: (2S,4R)-4-phenylpyrrolidine-2-carboxylic acid hydrochloride

InChI: InChI=1S/C11H13NO2.ClH/c13-11(14)10-6-9(7-12-10)8-4-2-1-3-5-8;/h1-5,9-10,12H,6-7H2,(H,13,14);1H/t9-,10-;/m0./s1

Composition: C (58.03%), H (6.20%), Cl (15.57%), N (6.15%), O (14.05%)

Molar Mass: 227.69

Atom Count: 29

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 227.0713064
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey LWFBRHSTNWMMGN-IYPAPVHQSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.63
Topological Polar Surface Area 49.33
Polarizability 20.84
Ring Count 2
Rotatable Bond Count 2

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