Basic information
- CAS
134974-37-1- Standard SMILES
Clc1cc2c(cc1Cl)Oc1c(cc(Br)c(Br)c1Cl)O2- InChIKey
CAPCTZJHYADFNX-UHFFFAOYSA-N- Molecular formula
- C12H3Br2Cl3O2
- Average molar mass
- 445.3 g/mol
- Monoisotopic mass
- 441.75654
Names & identifiers
- Preferred name
- 2,3-Dibromo-1,7,8-trichlorodibenzo-p-dioxin
- IUPAC
- 2,3-dibromo-1,7,8-trichlorodibenzo-p-dioxin
Names & synonyms
2,3-dibromo-1,7,8-trichlorodibenzo-p-dioxin134974-37-1Dibenzo(b,e)(1,4)dioxin, 2,3-dibromo-1.7,8-trichloro-2,3-dibromo-1,7,8-trichlorooxanthreneDTXSID70159175CAPCTZJHYADFNX-UHFFFAOYSA-N
Database identifiers
- CAS
134974-37-1- PubChem CID
- 178223
- DTXSID
DTXSID70159175- Nikkaji
- J590.391B
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
Loading…