2,3,6,7-Tetrachloronaphthalene-1,4-dione
Basic information
- CAS
90948-25-7- Standard SMILES
O=C1C(Cl)=C(Cl)C(=O)c2cc(Cl)c(Cl)cc21- InChIKey
JOHBAPGYFHJNAD-UHFFFAOYSA-N- Molecular formula
- C10H2Cl4O2
- Average molar mass
- 295.9 g/mol
- Monoisotopic mass
- 293.88089
Names & identifiers
- Preferred name
- 2,3,6,7-Tetrachloronaphthalene-1,4-dione
- IUPAC
- 2,3,6,7-tetrachloronaphthalene-1,4-dione
Names & synonyms
90948-25-72,3,6,7-tetrachloronaphthalene-1,4-dioneNSC526634SCHEMBL23271824SCHEMBL30003088DTXSID10326309NSC-526634DS-0084471,4-Naphthalenedione,2,3,6,7-tetrachloro-
Database identifiers
- CAS
90948-25-7- PubChem CID
- 352497
- DTXSID
DTXSID10326309
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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