Basic information
- Standard SMILES
CC(C)(O)C(O)CON1C(=O)c2ccccc2C1=O- InChIKey
PQMPQAWZAZXNBP-UHFFFAOYSA-N- Molecular formula
- C13H15NO5
- Average molar mass
- 265.26 g/mol
Names & identifiers
- Preferred name
- 2-(2,3-Dihydroxy-3-methyl-butoxy)-isoindole-1,3-dione
- IUPAC
- 2-(2,3-dihydroxy-3-methylbutoxy)isoindole-1,3-dione
Names & synonyms
SCHEMBL4859751PQMPQAWZAZXNBP-UHFFFAOYSA-N2-(2,3-dihydroxy-3-methyl-butoxy)-isoindole-1,3-dione
Database identifiers
- PubChem CID
- 22286453
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 357
Related reactions
3 records
Compound notes
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