3-(3,4-Dichlorophenyl)bicyclo[2.2.2]oct-2-ene-2-carbaldehyde
Basic information
- CAS
62374-04-3- Standard SMILES
O=CC1=C(c2ccc(Cl)c(Cl)c2)C2CCC1CC2- InChIKey
VEHQVTZYRJRLIR-UHFFFAOYSA-N- Molecular formula
- C15H14Cl2O
- Average molar mass
- 281.2 g/mol
- Monoisotopic mass
- 280.0421705
Names & identifiers
- Preferred name
- 3-(3,4-Dichlorophenyl)bicyclo[2.2.2]oct-2-ene-2-carbaldehyde
- IUPAC
- 3-(3,4-dichlorophenyl)bicyclo[2.2.2]oct-2-ene-2-carbaldehyde
Names & synonyms
62374-04-33-(3,4-Dichlorophenyl)bicyclo[2.2.2]oct-2-ene-2-carbaldehydeSCHEMBL10734250DTXSID80603159VEHQVTZYRJRLIR-UHFFFAOYSA-N3-formyl-2-(3,4-dichlorophenyl)bicyclo[2,2,2]oct-2-ene
Database identifiers
- CAS
62374-04-3- PubChem CID
- 20161611
- DTXSID
DTXSID80603159
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 369
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Related reactions
1 records
Compound notes
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