Specification
Synonyms
(S)-5-(Hydroxymethyl)-2-pyrrolidone
IUPAC Name
(5S)-5-(Hydroxymethyl)pyrrolidin-2-one
Canonical SMILES
C1CC(=O)NC1CO
InChI
InChI=1S/C5H9NO2/c7-3-4-1-2-5(8)6-4/h4,7H,1-3H2,(H,6,8)/t4-/m0/s1
InChI Key
HOBJEFOCIRXQKH-BYPYZUCNSA-N
Melting Point
79-80 °C(lit.)
Appearance
Crystals or crystalline powder
Storage
Inert atmosphere, room temperature
Isomeric SMILES
C1CC(=O)N[C@@H]1CO
Monoisotopic Mass
115.06332853
pKa
14.35±0.10(Predicted)
Topological Polar Surface Area
49.3 Ų