Basic information
- CAS
18346-83-3- Standard SMILES
CC(C)CC(=O)C1C(c2ccccc2)CC(=O)C(C(C)C)C1c1ccccc1- InChIKey
PMEIYUNEINNLCA-UHFFFAOYSA-N- Molecular formula
- C26H32O2
- Average molar mass
- 376.5 g/mol
- Monoisotopic mass
- 376.24023026
Names & identifiers
- Preferred name
- 4-(3-Methylbutanoyl)-3,5-diphenyl-2-propan-2-ylcyclohexan-1-one
- IUPAC
- 4-(3-methylbutanoyl)-3,5-diphenyl-2-propan-2-ylcyclohexan-1-one
Names & synonyms
18346-83-3NSC3380094-(3-methylbutanoyl)-3,5-diphenyl-2-propan-2-ylcyclohexan-1-oneDTXSID50330945NSC-3380092~2~-(3-Methylbutanoyl)-2~4~-(propan-2-yl)-2~1~,2~3~,2~4~,2~6~-tetrahydro[1~1~,2~1~:2~3~,3~1~-terphenyl]-2~5~(2~2~H)-one
Database identifiers
- CAS
18346-83-3- PubChem CID
- 433767
- DTXSID
DTXSID50330945
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 523
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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