Basic information
- CAS
82056-04-0- Standard SMILES
Oc1c(O)c2c(c(Cl)c1Cl)Oc1c(Cl)cccc1O2- InChIKey
BXJZLVMFLVLGBO-UHFFFAOYSA-N- Molecular formula
- C12H5Cl3O4
- Average molar mass
- 319.5 g/mol
- Monoisotopic mass
- 317.925342
Names & identifiers
- Preferred name
- 3,4,6-Trichlorooxanthrene-1,2-diol
- IUPAC
- 3,4,6-trichlorodibenzo-p-dioxin-1,2-diol
Names & synonyms
3,4,6-trichlorooxanthrene-1,2-diol82056-04-0DTXSID80231552RefChem:270635DTXCID10154043trichlorodihydroxydibenzo-p-dioxin
Database identifiers
- CAS
82056-04-0- PubChem CID
- 186247
- DTXSID
DTXSID80231552
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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