1,3,8-Tribromo-2,7-dichlorooxanthrene
Basic information
- CAS
122418-71-7- Standard SMILES
Clc1cc2c(cc1Br)Oc1c(cc(Br)c(Cl)c1Br)O2- InChIKey
OYNAEZUDNSHEQU-UHFFFAOYSA-N- Molecular formula
- C12H3Br3Cl2O2
- Average molar mass
- 489.8 g/mol
- Monoisotopic mass
- 485.70602
Names & identifiers
- Preferred name
- 1,3,8-Tribromo-2,7-dichlorooxanthrene
- IUPAC
- 1,3,8-tribromo-2,7-dichlorodibenzo-p-dioxin
Names & synonyms
1,3,8-Tribromo-2,7-dichlorooxanthrene122418-71-7DTXSID30153598
Database identifiers
- CAS
122418-71-7- PubChem CID
- 180101
- DTXSID
DTXSID30153598- Nikkaji
- J590.380G
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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