2-Pyrrolidinone, 5-(phenylmethoxy)-1-(phenylsulfonyl)-
Basic information
- CAS
111711-95-6- Standard SMILES
O=C1CCC(OCc2ccccc2)N1S(=O)(=O)c1ccccc1- InChIKey
YRZCBUSJFOXKAJ-UHFFFAOYSA-N- Molecular formula
- C17H17NO4S
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.0878292
Names & identifiers
- Preferred name
- 2-Pyrrolidinone, 5-(phenylmethoxy)-1-(phenylsulfonyl)-
- IUPAC
- 1-(benzenesulfonyl)-5-phenylmethoxypyrrolidin-2-one
Names & synonyms
111711-95-62-Pyrrolidinone, 5-(phenylmethoxy)-1-(phenylsulfonyl)-RefChem:1064778BRN 47607655-(Phenylmethoxy)-1-(phenylsulfonyl)-2-pyrrolidinone5-(PHENYLMETHOXY)-1-(PHENYLSULFONYL)PYRROLIDIN-2-ONESCHEMBL96704021-(BENZENESULFONYL)-5-(BENZYLOXY)PYRROLIDIN-2-ONEDTXSID10920548YRZCBUSJFOXKAJ-UHFFFAOYSA-N1-benzenesulphonyl-2-oxo-5-benzyloxypyrrolidine
Database identifiers
- CAS
111711-95-6- PubChem CID
- 3086728
- DTXSID
DTXSID10920548- Nikkaji
- J423.515K
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 501
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Related reactions
2 records
Compound notes
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