2,3,4-Tribromo-dibenzofuran
Basic information
- CAS
617707-50-3- Standard SMILES
Brc1cc2c(oc3ccccc32)c(Br)c1Br- InChIKey
PLNFQSTVRAQHRA-UHFFFAOYSA-N- Molecular formula
- C12H5Br3O
- Average molar mass
- 404.88 g/mol
- Monoisotopic mass
- 401.78905
Names & identifiers
- Preferred name
- 2,3,4-Tribromo-dibenzofuran
- IUPAC
- 2,3,4-tribromodibenzofuran
Names & synonyms
2,3,4-tribromo-dibenzofuran617707-50-3DTXSID20335664RefChem:243995DTXCID70286753PLNFQSTVRAQHRA-UHFFFAOYSA-N2,3,4-tribromodibenzofuran2,3,4-Tribromodibenzo[b,d]furan
Database identifiers
- CAS
617707-50-3- PubChem CID
- 526317
- DTXSID
DTXSID20335664
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 273
Experimental & physicochemical properties
Collision Cross Section153.5 Ų [M]+ [CCS Type: TIMS, Method: calibration with PAHs]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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