Basic information
- CAS
94650-97-2- Standard SMILES
O=C1C=C(Cl)C(Cl)C1=O- InChIKey
UYKMFOOBSVRLMV-UHFFFAOYSA-N- Molecular formula
- C5H2Cl2O2
- Average molar mass
- 164.97 g/mol
- Monoisotopic mass
- 163.9431847
Names & identifiers
- Preferred name
- 4,5-Dichlorocyclopent-3-ene-1,2-dione
- IUPAC
- 4,5-dichlorocyclopent-3-ene-1,2-dione
Names & synonyms
94650-97-24,5-dichlorocyclopent-3-ene-1,2-dioneDTXSID209153843-Cyclopentene-1,2-dione, dichloro-
Database identifiers
- CAS
94650-97-2- PubChem CID
- 56791
- DTXSID
DTXSID20915384
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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