2-Pyrrolidinone, 5-hydroxy-1-(phenylsulfonyl)-

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Basic information

CAS: 111711-97-8
Standard SMILES: O=C1CCC(O)N1S(=O)(=O)c1ccccc1
InChIKey: LJDRTKSCZIXLQV-UHFFFAOYSA-N
Molecular formula: C10H11NO4S
Average molar mass: 241.27 g/mol
Monoisotopic mass: 241.04087901

Names & identifiers

Preferred name: 2-Pyrrolidinone, 5-hydroxy-1-(phenylsulfonyl)-
IUPAC: 1-(benzenesulfonyl)-5-hydroxypyrrolidin-2-one

Names & synonyms

111711-97-82-Pyrrolidinone, 5-hydroxy-1-(phenylsulfonyl)-RefChem:1064796BRN 47509905-Hydroxy-1-(phenylsulfonyl)-2-pyrrolidinone1-(benzenesulfonyl)-5-hydroxypyrrolidin-2-oneSCHEMBL9670022DTXSID70920549LJDRTKSCZIXLQV-UHFFFAOYSA-N1-benzenesulphonyl-2-oxo-5-hydroxypyrrolidine

Database identifiers

CAS: 111711-97-8
PubChem CID: 3086729
DTXSID: DTXSID70920549

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 83.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 367

Related reactions

1 records

New reaction record

HRID 1761888As productuspto-grants-1989_05

Compound notes

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