Basic information
- Standard SMILES
O=c1oc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ns1- InChIKey
KADIGRTZOVFWEB-UHFFFAOYSA-N- Molecular formula
- C10H3F6NO2S
- Average molar mass
- 315.19 g/mol
Names & identifiers
- Preferred name
- 5-(alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-3,5-xylyl)-1,3,4-oxathiazol-2-one
- IUPAC
- 5-[3,5-bis(trifluoromethyl)phenyl]-1,3,4-oxathiazol-2-one
Names & synonyms
5-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-1,3,4-oxathiazol-2-oneSCHEMBL113905655-(alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-3,5- Xylyl)-1,3,4-Oxathiazol-2-One
Database identifiers
- PubChem CID
- 12437403
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 64 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 410
Related reactions
6 records
Compound notes
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