Basic information
- CAS
617708-11-9- Standard SMILES
Brc1cc(Br)c2oc3c(Br)c(Br)cc(Br)c3c2c1- InChIKey
PLLLQRORRMHTHR-UHFFFAOYSA-N- Molecular formula
- C12H3Br5O
- Average molar mass
- 562.7 g/mol
- Monoisotopic mass
- 557.61008
Names & identifiers
- Preferred name
- 1,3,4,6,8-Pentabromo-dibenzofuran
- IUPAC
- 1,3,4,6,8-pentabromodibenzofuran
Names & synonyms
1,3,4,6,8-pentabromo-dibenzofuran617708-11-9DTXSID80335625RefChem:216789DTXCID30286714PLLLQRORRMHTHR-UHFFFAOYSA-N1,3,4,6,8-Pentabromodibenzo[b,d]furan
Database identifiers
- CAS
617708-11-9- PubChem CID
- 526263
- DTXSID
DTXSID80335625
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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