1-(Cyclohepta-2,4,6-trien-1-yl)pyrrolidine-2,5-dione
Basic information
- CAS
92288-17-0- Standard SMILES
O=C1CCC(=O)N1C1C=CC=CC=C1- InChIKey
PNUYKMCWUWEHCH-UHFFFAOYSA-N- Molecular formula
- C11H11NO2
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.07897859
Names & identifiers
- Preferred name
- 1-(Cyclohepta-2,4,6-trien-1-yl)pyrrolidine-2,5-dione
- IUPAC
- 1-cyclohepta-2,4,6-trien-1-ylpyrrolidine-2,5-dione
Names & synonyms
1-(cyclohepta-2,4,6-trien-1-yl)pyrrolidine-2,5-dione92288-17-0DTXSID40301503RefChem:226396DTXCID90252637NSC143792NSC-143792
Database identifiers
- CAS
92288-17-0- PubChem CID
- 286085
- DTXSID
DTXSID40301503
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 320
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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