Basic information
- Standard SMILES
CC(CCCC(=O)CCCC(C)(C(=O)O)c1ccccc1)(C(=O)O)c1ccccc1- InChIKey
IQLPABDFKBFCLG-UHFFFAOYSA-N- Molecular formula
- C25H30O5
- Average molar mass
- 410.5 g/mol
Names & identifiers
- Preferred name
- 2,10-dimethyl-6-oxo-2,10-diphenyl-undecanedioic Acid
- IUPAC
- 2,10-dimethyl-6-oxo-2,10-diphenylundecanedioic acid
Names & synonyms
CHEMBL187881SCHEMBL32783892,10-dimethyl-6-oxo-2,10-diphenyl-undecanedioic AcidIQLPABDFKBFCLG-UHFFFAOYSA-N2,10-Dimethyl-6-oxo-2,10-diphenylundecanedioic acid
Database identifiers
- PubChem CID
- 10201633
- ChEMBL
CHEMBL187881
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 538
Related reactions
6 records
Compound notes
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