Basic information
- Standard SMILES
O=Cc1ccccc1-c1ccc2c(c1C=O)OCO2- InChIKey
AINSOBFWRPHTDB-UHFFFAOYSA-N- Molecular formula
- C15H10O4
- Average molar mass
- 254.24 g/mol
Names & identifiers
- Preferred name
- 5-(2-Formylphenyl)-1,3-benzodioxole-4-carbaldehyde
- IUPAC
- 5-(2-formylphenyl)-1,3-benzodioxole-4-carbaldehyde
Names & synonyms
SCHEMBL2211320AINSOBFWRPHTDB-UHFFFAOYSA-N5-(2-formylphenyl)-1,3-benzodioxole-4-carbaldehyde
Database identifiers
- PubChem CID
- 58484347
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 343
Related reactions
2 records
Compound notes
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