Basic information
- CAS
50585-37-0- Standard SMILES
Brc1cc2c(cc1Br)Oc1ccccc1O2- InChIKey
OBHJJRTXDMGYAE-UHFFFAOYSA-N- Molecular formula
- C12H6Br2O2
- Average molar mass
- 341.98 g/mol
- Monoisotopic mass
- 339.87345
Names & identifiers
- Preferred name
- 2,3-Dibromodibenzo-P-dioxin
- IUPAC
- 2,3-dibromodibenzo-p-dioxin
- English name
- 2,3-Dibromodibenzo-p-dioxin
- Molecular formula
- C12H6Br2O2
- Molecular weight
- 341.98
Names & synonyms
2,3-DIBROMODIBENZO-P-DIOXIN50585-37-02,3-dibromooxanthreneDibenzo(b,e)(1,4)dioxin, 2,3-dibromo-2,3-dibromo-dibenzo-p-dioxinSCHEMBL9657877DTXSID60872028DB-2602932,3-Dibromodibenzo[b,e][1,4]dioxin2,3-dibromodibenzo[b,e][1,4]dioxineDibenzo[b,e][1,4]dioxin, 2,3-dibromo-
Database identifiers
- CAS
50585-37-0- PubChem CID
- 39725
- DTXSID
DTXSID60872028- Nikkaji
- J89.564D
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 235
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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