Basic information
- Standard SMILES
CCOC(=O)C1(c2ccc(O)cc2)Cc2c(c(OC)c(OC)c(OC)c2OC)C1- InChIKey
PFFAREWBAJINFK-UHFFFAOYSA-N- Molecular formula
- C22H26O7
- Average molar mass
- 402.4 g/mol
- Monoisotopic mass
- 402.16785316
Names & identifiers
- Preferred name
- Ethyl 2-(4-hydroxyphenyl)-4,5,6,7-tetramethoxy-2-indancarboxylate
- IUPAC
- ethyl 2-(4-hydroxyphenyl)-4,5,6,7-tetramethoxy-1,3-dihydroindene-2-carboxylate
Names & synonyms
SCHEMBL7974595PFFAREWBAJINFK-UHFFFAOYSA-NEthyl 2-(4-hydroxyphenyl)-4,5,6,7-tetramethoxy-2-indancarboxylate
Database identifiers
- PubChem CID
- 18348564
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 519
Related reactions
4 records
Compound notes
Loading…