Cyclohexanone, 2,6-dichloro-4-(1,1-dimethylethyl)-
Basic information
- CAS
54973-68-1- Standard SMILES
CC(C)(C)C1CC(Cl)C(=O)C(Cl)C1- InChIKey
YMUAIEVPXWTMPQ-UHFFFAOYSA-N- Molecular formula
- C10H16Cl2O
- Average molar mass
- 223.14 g/mol
- Monoisotopic mass
- 222.0578205
Names & identifiers
- Preferred name
- Cyclohexanone, 2,6-dichloro-4-(1,1-dimethylethyl)-
- IUPAC
- 4-tert-butyl-2,6-dichlorocyclohexan-1-one
Names & synonyms
Cyclohexanone, 2,6-dichloro-4-(1,1-dimethylethyl)-54973-68-1DTXSID70301031RefChem:335547DTXCID202521654-tert-butyl-2,6-dichlorocyclohexan-1-oneNSC140628NSC-140628DS-010689Cyclohexanone,6-dichloro-4-(1,1-dimethylethyl)-
Database identifiers
- CAS
54973-68-1- PubChem CID
- 284599
- DTXSID
DTXSID70301031
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
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Compound notes
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