Basic information
- CAS
5273-62-1- Standard SMILES
O=C1C=CC(=O)C(Cl)C1Cl- InChIKey
KCNUKOVIWCXTJL-UHFFFAOYSA-N- Molecular formula
- C6H4Cl2O2
- Average molar mass
- 179 g/mol
- Monoisotopic mass
- 177.9588348
Names & identifiers
- Preferred name
- 5,6-Dichlorocyclohex-2-ene-1,4-dione
- IUPAC
- 5,6-dichlorocyclohex-2-ene-1,4-dione
Names & synonyms
5,6-dichlorocyclohex-2-ene-1,4-dione5273-62-1NSC 267306NSC267306SCHEMBL801782DTXSID70313194NSC-267306DS-008872
Database identifiers
- CAS
5273-62-1- PubChem CID
- 320296
- DTXSID
DTXSID70313194- Nikkaji
- J1.092.215A
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 188
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…