Basic information
- Standard SMILES
COC(=O)Cc1cc(C(=O)c2ccc(OCC(C)C)cc2OCC(C)C)ccc1OCC(C)C- InChIKey
FCSLWSSMEXSWGC-UHFFFAOYSA-N- Molecular formula
- C28H38O6
- Average molar mass
- 470.6 g/mol
- Monoisotopic mass
- 470.26683893
Names & identifiers
- Preferred name
- Methyl 2-[5-(2,4-diisobutoxybenzoyl)-2-isobutoxyphenyl]acetate
- IUPAC
- methyl 2-[5-[2,4-bis(2-methylpropoxy)benzoyl]-2-(2-methylpropoxy)phenyl]acetate
Names & synonyms
SCHEMBL4291381FCSLWSSMEXSWGC-UHFFFAOYSA-Nmethyl 2-[5-(2,4-diisobutoxybenzoyl)-2-isobutoxyphenyl]acetate
Database identifiers
- PubChem CID
- 17816545
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 14
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 616
Related reactions
6 records
Compound notes
Loading…