Basic information
- CAS
15743-13-2- Standard SMILES
O=C1C(Cl)=C(Cl)C(=O)C1(Cl)Cl- InChIKey
QXHDKANPDPYPIC-UHFFFAOYSA-N- Molecular formula
- C5Cl4O2
- Average molar mass
- 233.9 g/mol
- Monoisotopic mass
- 231.86524
Names & identifiers
- Preferred name
- 2,2,4,5-Tetrachloro-4-cyclopentene-1,3-dione
- IUPAC
- 2,2,4,5-tetrachlorocyclopent-4-ene-1,3-dione
Names & synonyms
15743-13-2Tetrachlorocyclopentene-2,4-dione2,2,4,5-Tetrachloro-4-cyclopentene-1,3-dioneDTXSID90166260RefChem:1059012DTXCID00887512,2,4,5-tetrachlorocyclopent-4-ene-1,3-dione4-Cyclopentene-1,3-dione, 2,2,4,5-tetrachloro-2,2,4,5-Tetrachlorocyclopentene-1,3-dioneCCRIS 7947Perchlorocyclopentene-3,5-dione2,2,4,5-Tetrachlorocyclopentenedione
Show more names
AI3-270492,2,4,5-Tetrachlorocyclopenten-1,3-dioneQXHDKANPDPYPIC-UHFFFAOYSA-NNSC44613perchloro-4-cyclopentene-1,3-dioneNSC 44613NSC-446134-Cyclopentene-1,3-dione, tetrachloro-
Database identifiers
- CAS
15743-13-2- PubChem CID
- 95953
- DTXSID
DTXSID90166260- Nikkaji
- J3.463.545E
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 252
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…