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(3S,4S)-4-(hydroxymethyl)pyrrolidin-3-ol hydrochloride

(3S,4S)-4-(hydroxymethyl)pyrrolidin-3-ol hydrochloride

CAS: 849935-79-1

Formula: C5H12ClNO2

SMILES: Cl.OC[C@@H]1CNC[C@H]1O

IUPAC: (3S,4S)-4-(hydroxymethyl)pyrrolidin-3-ol hydrochloride

InChI: InChI=1S/C5H11NO2.ClH/c7-3-4-1-6-2-5(4)8;/h4-8H,1-3H2;1H/t4-,5+;/m0./s1

Composition: C (39.10%), H (7.87%), Cl (23.08%), N (9.12%), O (20.83%)

Molar Mass: 153.61

Atom Count: 21

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 153.0556563
Formal Charge 0
FSP3 1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey VXKQZDCFEDEAAX-UYXJWNHNSA-N
Lipinski's Rule of Five 1
Molar Refractivity 29.54
Topological Polar Surface Area 52.49
Polarizability 12
Ring Count 1
Rotatable Bond Count 1

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97% <2 Days 849935-79-1 $572.70-$7,912.00$572.70$917.70$1,472.00$2,162.00$7,912.00
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