1-cyclohexyl-1-hydroxy-6-methoxy-3-phenyl-1H-indene-2-carboxylic acid ethyl ester
Basic information
- Standard SMILES
CCOC(=O)C1=C(c2ccccc2)c2ccc(OC)cc2C1(O)C1CCCCC1- InChIKey
PBJWWUVLNQSUFG-UHFFFAOYSA-N- Molecular formula
- C25H28O4
- Average molar mass
- 392.5 g/mol
- Monoisotopic mass
- 392.19875937
Names & identifiers
- Preferred name
- 1-cyclohexyl-1-hydroxy-6-methoxy-3-phenyl-1H-indene-2-carboxylic acid ethyl ester
- IUPAC
- ethyl 1-cyclohexyl-1-hydroxy-6-methoxy-3-phenylindene-2-carboxylate
Names & synonyms
SCHEMBL3565999PBJWWUVLNQSUFG-UHFFFAOYSA-N1-cyclohexyl-1-hydroxy-6-methoxy-3-phenyl-1H-indene-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 11639752
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 614
Related reactions
3 records
Compound notes
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