Basic information
- CAS
14053-16-8- Standard SMILES
CC(=O)Oc1ccc(N2CCCC2=O)cc1- InChIKey
FPQOGNXITGCHBL-UHFFFAOYSA-N- Molecular formula
- C12H13NO3
- Average molar mass
- 219.24 g/mol
- Monoisotopic mass
- 219.08954328
Names & identifiers
- Preferred name
- 2-Pyrrolidinone, 1-(p-hydroxyphenyl)-, acetate (ester)
- IUPAC
- [4-(2-oxopyrrolidin-1-yl)phenyl] acetate
- English name
- 1-(p-Acetyloxyphenyl)-2-pyrrolidone
- Molecular weight
- 0
Names & synonyms
1-(p-Hydroxyphenyl)-2-pyrrolidinone acetate14053-16-8BRN 02112962-Pyrrolidinone, 1-(p-hydroxyphenyl)-, acetate (ester)DTXSID101614344-21-00-03155 (Beilstein Handbook Reference)RefChem:266870DTXCID4083925[4-(2-oxopyrrolidin-1-yl)phenyl] acetate4-(2-OXOPYRROLIDIN-1-YL)PHENYL ACETATESCHEMBL66161681-(p-Acetyloxyphenyl)-2-pyrrolidone
Database identifiers
- CAS
14053-16-8- PubChem CID
- 203239
- DTXSID
DTXSID10161434- Nikkaji
- J107.081I
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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