Basic information
- CAS
7499-46-9- Standard SMILES
CC1CCC(C(C)C)C(OC2(c3ccccc3)OC(=O)c3ccccc32)C1- InChIKey
IRVNXTZDUTXMJY-UHFFFAOYSA-N- Molecular formula
- C24H28O3
- Average molar mass
- 364.5 g/mol
- Monoisotopic mass
- 364.20384475
Names & identifiers
- Preferred name
- 3-((2-Isopropyl-5-methylcyclohexyl)oxy)-3-phenyl-2-benzofuran-1(3H)-one
- IUPAC
- 3-(5-methyl-2-propan-2-ylcyclohexyl)oxy-3-phenyl-2-benzofuran-1-one
Names & synonyms
7499-46-9NSC407659NSC 4076593-((2-Isopropyl-5-methylcyclohexyl)oxy)-3-phenyl-2-benzofuran-1(3H)-oneDTXSID709964863-(5-methyl-2-propan-2-ylcyclohexyl)oxy-3-phenyl-2-benzo[b]furan-1-oneNSC-4076593-(2-isopropyl-5-methyl-cyclohexoxy)-3-phenyl-isobenzofuran-1-one3-{[5-Methyl-2-(propan-2-yl)cyclohexyl]oxy}-3-phenyl-2-benzofuran-1(3H)-one
Database identifiers
- CAS
7499-46-9- PubChem CID
- 348386
- DTXSID
DTXSID70996486
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 524
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…