2,3,7,8-Tetrafluoro DBD
Basic information
- CAS
100231-56-9- Standard SMILES
Fc1cc2c(cc1F)Oc1cc(F)c(F)cc1O2- InChIKey
NOZDVIWMUAUYAV-UHFFFAOYSA-N- Molecular formula
- C12H4F4O2
- Average molar mass
- 256.15 g/mol
- Monoisotopic mass
- 256.01474201
Names & identifiers
- Preferred name
- 2,3,7,8-Tetrafluoro DBD
- IUPAC
- 2,3,7,8-tetrafluorodibenzo-p-dioxin
Names & synonyms
2,3,7,8-Tetrafluoro DBD100231-56-92,3,7,8,-Tetrafluorodibenzo-p-dioxin2,3,7,8-tetrafluorodibenzo-p-dioxin2,3,7,8-TETRAFLUOROOXANTHRENEDTXSID80143040NOZDVIWMUAUYAV-UHFFFAOYSA-NNS00123830
Database identifiers
- CAS
100231-56-9- PubChem CID
- 180787
- DTXSID
DTXSID80143040- Nikkaji
- J622.631K
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 258
Experimental & physicochemical properties
LogP3.5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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