Basic information
- CAS
16012-83-2- Standard SMILES
Fc1c(F)c(F)c2c(c1F)Sc1c(F)c(F)c(F)c(F)c1S2- InChIKey
BCMGBEQPFANKSN-UHFFFAOYSA-N- Molecular formula
- C12F8S2
- Average molar mass
- 360.2 g/mol
- Monoisotopic mass
- 359.93136764
Names & identifiers
- Preferred name
- Thianthrene, octafluoro-
- IUPAC
- 1,2,3,4,6,7,8,9-octafluorothianthrene
- English name
- Octafluorothianthrene
- Molecular formula
- C12F8S2
- Molecular weight
- 360.25
Names & synonyms
Thianthrene, octafluoro-Octafluorothianthrene16012-83-2DTXSID90348206RefChem:384487DTXCID80299278BCMGBEQPFANKSN-UHFFFAOYSA-N1,2,3,4,6,7,8,9-OctafluorothianthreneperfluorothianthreneSCHEMBL95088981,2,3,4,6,7,8,9-Octafluorothianthrene #Thianthrene, 1,2,3,4,6,7,8,9-octafluoro-
Database identifiers
- CAS
16012-83-2- PubChem CID
- 632297
- DTXSID
DTXSID90348206- Nikkaji
- J130.392I
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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