1,6-Dibromo-4,9-dichlorooxanthrene
Basic information
- CAS
122418-79-5- Standard SMILES
Clc1ccc(Br)c2c1Oc1c(Br)ccc(Cl)c1O2- InChIKey
SNYMINWQTNGKHB-UHFFFAOYSA-N- Molecular formula
- C12H4Br2Cl2O2
- Average molar mass
- 410.9 g/mol
- Monoisotopic mass
- 407.79551
Names & identifiers
- Preferred name
- 1,6-Dibromo-4,9-dichlorooxanthrene
- IUPAC
- 1,6-dibromo-4,9-dichlorodibenzo-p-dioxin
Names & synonyms
1,6-Dibromo-4,9-dichlorooxanthrene122418-79-5DTXSID20153603RefChem:221509DTXCID5076094SNYMINWQTNGKHB-UHFFFAOYSA-NDibenzodioxin, 1,6-dibromo-, 4,9-dichloro-
Database identifiers
- CAS
122418-79-5- PubChem CID
- 180106
- DTXSID
DTXSID20153603
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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