Basic information
- Standard SMILES
COC(=O)C1=C(c2ccccc2)c2ccc(O)cc2C1=O- InChIKey
SPOJCJWSRNTDOW-UHFFFAOYSA-N- Molecular formula
- C17H12O4
- Average molar mass
- 280.27 g/mol
Names & identifiers
- Preferred name
- 6-hydroxy-1-oxo-3-phenyl-1H-indene-2-carboxylic acid methyl ester
- IUPAC
- methyl 5-hydroxy-3-oxo-1-phenylindene-2-carboxylate
Names & synonyms
SCHEMBL3578768SPOJCJWSRNTDOW-UHFFFAOYSA-N6-hydroxy-1-oxo-3-phenyl-1H-indene-2-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 68700263
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 473
Related reactions
4 records
Compound notes
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