Basic information
- CAS
122418-91-1- Standard SMILES
Clc1cc2c(c(Br)c1Cl)Oc1c(Cl)c(Cl)cc(Br)c1O2- InChIKey
HTEIPUBXXHXROD-UHFFFAOYSA-N- Molecular formula
- C12H2Br2Cl4O2
- Average molar mass
- 479.8 g/mol
- Monoisotopic mass
- 475.71757
Names & identifiers
- Preferred name
- Dibenzo(b,e)(1,4)dioxin, 1,6-dibromo-2,3,8,9-tetrachloro-
- IUPAC
- 1,6-dibromo-2,3,8,9-tetrachlorodibenzo-p-dioxin
Names & synonyms
1,6-Dibromo-2,3,8,9-tetrachlorooxanthrene122418-91-1Dibenzo(b,e)(1,4)dioxin, 1,6-dibromo-2,3,8,9-tetrachloro-DTXSID80153609RefChem:337073DTXCID20761001,6-dibromo-2,3,8,9-tetrachloro-dibenzo-p-dioxinHTEIPUBXXHXROD-UHFFFAOYSA-N
Database identifiers
- CAS
122418-91-1- PubChem CID
- 183552
- DTXSID
DTXSID80153609
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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