Basic information
- Standard SMILES
CCOC(=O)C1C(c2ccccc2)c2ccccc2C1(O)c1ccc2c(c1)OCO2- InChIKey
HCCVARBYSXPHNT-UHFFFAOYSA-N- Molecular formula
- C25H22O5
- Average molar mass
- 402.4 g/mol
Names & identifiers
- Preferred name
- Ethyl (1RS)-1-Hydroxy-1-(3,4-methylenedioxyphenyl)-3-phenylindane-2-carboxylate
- IUPAC
- ethyl 3-(1,3-benzodioxol-5-yl)-3-hydroxy-1-phenyl-1,2-dihydroindene-2-carboxylate
Names & synonyms
HCCVARBYSXPHNT-UHFFFAOYSA-NEthyl (1RS)-1-Hydroxy-1-(3,4-methylenedioxyphenyl)-3-phenylindane-2-carboxylate
Database identifiers
- PubChem CID
- 56991973
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 617
Related reactions
1 records
Compound notes
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