Basic information
- Standard SMILES
O=S(=O)(CCl)Nc1ccnn1-c1c(Cl)cc(C(F)(F)F)cc1Cl- InChIKey
PXGIMSVMZHMGDK-UHFFFAOYSA-N- Molecular formula
- C11H7Cl3F3N3O2S
- Average molar mass
- 408.6 g/mol
- Monoisotopic mass
- 406.927665
Names & identifiers
- Preferred name
- 5-Chloromethanesulphonamido-1-(2,6-dichloro-4-trifluoromethylphenyl)-pyrazole
- IUPAC
- 1-chloro-N-[2-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazol-3-yl]methanesulfonamide
Names & synonyms
5-chloromethanesulphonamido-1-(2,6-dichloro-4-trifluoromethylphenyl)-pyrazoleSCHEMBL10520101
Database identifiers
- PubChem CID
- 13712704
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 72.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 505
Related reactions
1 records
Compound notes
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