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(2S,3S)-1-benzyl-3-hydroxypyrrolidine-2-carboxylic acid hydrochloride

(2S,3S)-1-benzyl-3-hydroxypyrrolidine-2-carboxylic acid hydrochloride

CAS: 1422284-79-4

Formula: C12H16ClNO3

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

IUPAC: (2S,3S)-1-benzyl-3-hydroxypyrrolidine-2-carboxylic acid hydrochloride

InChI: InChI=1S/C12H15NO3.ClH/c14-10-6-7-13(11(10)12(15)16)8-9-4-2-1-3-5-9;/h1-5,10-11,14H,6-8H2,(H,15,16);1H/t10-,11-;/m0./s1

Composition: C (55.93%), H (6.26%), Cl (13.76%), N (5.44%), O (18.62%)

Molar Mass: 257.71

Atom Count: 33

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 257.0818711
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey RZHJKFSSCLFIJM-ACMTZBLWSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.29
Topological Polar Surface Area 60.77
Polarizability 23.31
Ring Count 2
Rotatable Bond Count 3

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95% 1 Day 1422284-79-4 $235.87-$2,476.66$235.87$412.78$825.55$2,476.66
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