Basic information
- CAS
17128-19-7- Standard SMILES
CN(C)c1ccc(N=Nc2ccc(SC(F)(F)F)cc2[N+](=O)[O-])cc1- InChIKey
LURNNCFIVKSZOO-UHFFFAOYSA-N- Molecular formula
- C15H13F3N4O2S
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.07113133
Names & identifiers
- Preferred name
- N,N-Dimethyl-4-[2-nitro-4-(trifluoromethylthio)phenylazo]aniline
- IUPAC
- N,N-dimethyl-4-[[2-nitro-4-(trifluoromethylsulfanyl)phenyl]diazenyl]aniline
Names & synonyms
LURNNCFIVKSZOO-FMQUCBEESA-NDTXSID401039311N,N-Dimethyl-4-[2-nitro-4-(trifluoromethylthio)phenylazo]anilineAKOS000521884AKOS03445077017128-19-7Z56755446Benzenamine, N,N-dimethyl-4-[2-[2-nitro-4-[(trifluoromethyl)thio]phenyl]diazenyl]-N,N-Dimethyl-4-((E)-(2-nitro-4-[(trifluoromethyl)sulfanyl]phenyl)diazenyl)aniline #
Database identifiers
- CAS
17128-19-7- PubChem CID
- 577404
- DTXSID
DTXSID401039311
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 476
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…