Completing data — usually done within a minute
Basic information
- CAS
136409-99-9- Standard SMILES
COC1CCC(=O)N1C(=O)c1ccccc1- InChIKey
ZCHBAECBIORSSH-UHFFFAOYSA-N- Molecular formula
- C12H13NO3
- Average molar mass
- 219.24 g/mol
- Monoisotopic mass
- 219.08954328
Names & identifiers
- Preferred name
- 1-Benzoyl-5-methoxypyrrolidin-2-one
- IUPAC
- 1-benzoyl-5-methoxypyrrolidin-2-one
Names & synonyms
1-benzoyl-5-methoxypyrrolidin-2-one136409-99-9DTXSID40929382RefChem:1054947DTXCID701358130BRN 4747637(+-)-1-Benzoyl-5-methoxy-2-pyrrolidinone2-Pyrrolidinone, 1-benzoyl-5-methoxy-, (+-)-1-benzoyl 5-methoxy pyrrolidin-2-oneSCHEMBL9821171ZCHBAECBIORSSH-UHFFFAOYSA-N
Database identifiers
- CAS
136409-99-9- PubChem CID
- 3077930
- DTXSID
DTXSID40929382- Nikkaji
- J423.519C
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 284
Related reactions
2 records
Compound notes
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