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(3S)-1-benzylpyrrolidine-3-carboxylic acid hydrochloride

(3S)-1-benzylpyrrolidine-3-carboxylic acid hydrochloride

CAS: 1212293-24-7

Formula: C12H16ClNO2

SMILES: Cl.OC(=O)[C@H]1CCN(CC2=CC=CC=C2)C1

IUPAC: (3S)-1-benzylpyrrolidine-3-carboxylic acid hydrochloride

InChI: InChI=1S/C12H15NO2.ClH/c14-12(15)11-6-7-13(9-11)8-10-4-2-1-3-5-10;/h1-5,11H,6-9H2,(H,14,15);1H/t11-;/m0./s1

Composition: C (59.63%), H (6.67%), Cl (14.67%), N (5.79%), O (13.24%)

Molar Mass: 241.72

Atom Count: 32

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 241.0869565
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LFWISXSUMOTUQQ-MERQFXBCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.23
Topological Polar Surface Area 40.54
Polarizability 22.68
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1212293-24-7 $171.35-$2,012.50$171.35$228.85$343.85$572.70$2,012.50
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