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1-[(3S)-1-benzylpyrrolidin-3-yl]methanamine hydrochloride

1-[(3S)-1-benzylpyrrolidin-3-yl]methanamine hydrochloride

CAS: 131852-54-5

Formula: C12H19ClN2

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

IUPAC: 1-[(3S)-1-benzylpyrrolidin-3-yl]methanamine hydrochloride

InChI: InChI=1S/C12H18N2.ClH/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11;/h1-5,12H,6-10,13H2;1H/t12-;/m0./s1

Composition: C (63.56%), H (8.45%), Cl (15.63%), N (12.35%)

Molar Mass: 226.75

Atom Count: 34

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 226.1236763
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JPGWSESUXOMZEF-YDALLXLXSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.1
Topological Polar Surface Area 29.26
Polarizability 23.75
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 131852-54-5 $94.50-$354.38$94.50$354.38
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