Basic information
- CAS
136471-83-5- Standard SMILES
Clc1cc2c(c(Cl)c1Cl)Oc1c(Cl)c(Br)c(Cl)c(Cl)c1O2- InChIKey
YAIIPTFYYHXKFN-UHFFFAOYSA-N- Molecular formula
- C12HBrCl6O2
- Average molar mass
- 469.7 g/mol
- Monoisotopic mass
- 465.72911
Names & identifiers
- Preferred name
- Dibenzo-p-dioxin, 3-bromo-1,2,4,6,7,8-hexachloro-
- IUPAC
- 3-bromo-1,2,4,6,7,8-hexachlorodibenzo-p-dioxin
Names & synonyms
Dibenzo-p-dioxin, 3-bromo-1,2,4,6,7,8-hexachloro-3-Bromo-1,2,4,6,7,8-hexachlorooxanthrene3-bromo-1,2,4,6,7,8-hexachlorodibenzo-p-dioxin136471-83-5DTXSID40159809RefChem:337237DTXCID10823003-bromo,1,2,4,6,7,8-hexachloro-dibenzo-dioxinYAIIPTFYYHXKFN-UHFFFAOYSA-N
Database identifiers
- CAS
136471-83-5- PubChem CID
- 178335
- DTXSID
DTXSID40159809
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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