Basic information
- CAS
71711-99-4- Standard SMILES
COc1ccc(C(C)=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)cc1- InChIKey
SSVUNLJDADFVRJ-UHFFFAOYSA-N- Molecular formula
- C23H30O2
- Average molar mass
- 338.5 g/mol
- Monoisotopic mass
- 338.2245802
Names & identifiers
- Preferred name
- 2,6-Ditert-butyl-4-[1-(4-methoxyphenyl)ethylidene]cyclohexa-2,5-dien-1-one
- IUPAC
- 2,6-ditert-butyl-4-[1-(4-methoxyphenyl)ethylidene]cyclohexa-2,5-dien-1-one
Names & synonyms
71711-99-42,6-ditert-butyl-4-[1-(4-methoxyphenyl)ethylidene]cyclohexa-2,5-dien-1-oneNSC348906DTXSID80319642NSC-3489062,6-DI-TERT-BUTYL-4-[1-(4-METHOXYPHENYL)ETHYLIDENE]CYCLOHEXA-2,5-DIEN-1-ONE
Database identifiers
- CAS
71711-99-4- PubChem CID
- 335992
- DTXSID
DTXSID80319642
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 573
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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