N-(Difluoromethyl)-N-[4-[1-[2-(2,4-dinitrophenyl)hydrazinylidene]ethyl]phenyl]-4-methylbenzenesulfonamide
Basic information
- CAS
379726-77-9- Standard SMILES
CC(=NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(N(C(F)F)S(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
SPWXBMUJRVREPP-UHFFFAOYSA-N- Molecular formula
- C22H19F2N5O6S
- Average molar mass
- 519.5 g/mol
- Monoisotopic mass
- 519.10241084
Names & identifiers
- Preferred name
- N-(Difluoromethyl)-N-[4-[1-[2-(2,4-dinitrophenyl)hydrazinylidene]ethyl]phenyl]-4-methylbenzenesulfonamide
- IUPAC
- N-(difluoromethyl)-N-[4-[N-(2,4-dinitroanilino)-C-methylcarbonimidoyl]phenyl]-4-methylbenzenesulfonamide
Names & synonyms
DTXSID501110952AKOS030750182379726-77-9N-(Difluoromethyl)-N-[4-[1-[2-(2,4-dinitrophenyl)hydrazinylidene]ethyl]phenyl]-4-methylbenzenesulfonamide
Database identifiers
- CAS
379726-77-9- PubChem CID
- 5082689
- DTXSID
DTXSID501110952
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 162 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 7
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 903
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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