2,4,7,9-Tetrabromo-1,6-dichlorooxanthrene
Basic information
- CAS
122418-83-1- Standard SMILES
Clc1c(Br)cc(Br)c2c1Oc1c(Br)cc(Br)c(Cl)c1O2- InChIKey
NTTZZFNGJWZGFR-UHFFFAOYSA-N- Molecular formula
- C12H2Br4Cl2O2
- Average molar mass
- 568.7 g/mol
- Monoisotopic mass
- 563.61653
Names & identifiers
- Preferred name
- 2,4,7,9-Tetrabromo-1,6-dichlorooxanthrene
- IUPAC
- 2,4,7,9-tetrabromo-1,6-dichlorodibenzo-p-dioxin
Names & synonyms
2,4,7,9-Tetrabromo-1,6-dichlorooxanthrene122418-83-1DTXSID50924161RefChem:245945DTXCID2013530041,3,6,8-tetrabromo-4,9-dichloro-dibenzo-p-dioxinNTTZZFNGJWZGFR-UHFFFAOYSA-N
Database identifiers
- CAS
122418-83-1- PubChem CID
- 180109
- DTXSID
DTXSID50924161
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
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Compound notes
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