Basic information
- Standard SMILES
CCOC(=O)N1C(=O)C2CC=CCC2C1=O- InChIKey
PVDNTJAFZIVPOM-UHFFFAOYSA-N- Molecular formula
- C11H13NO4
- Average molar mass
- 223.22 g/mol
Names & identifiers
- Preferred name
- N-ethoxycarbonyl-1,2,3,6-tetrahydrophtalimide
- IUPAC
- ethyl 1,3-dioxo-3a,4,7,7a-tetrahydroisoindole-2-carboxylate
Names & synonyms
SCHEMBL5569659PVDNTJAFZIVPOM-UHFFFAOYSA-NN-ethoxycarbonyl-1,2,3,6-tetrahydrophtalimiden-ethoxycarbonyl-1,2,3,6-tetrahydrophthalimide
Database identifiers
- PubChem CID
- 23628680
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 348
Related reactions
1 records
Compound notes
Loading…