Basic information
- CAS
72361-40-1- Standard SMILES
CCN(CC[n+]1ccccc1)c1ccc(N=Nc2c(Br)cc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1.[Cl-]- InChIKey
BZSGZDPYHAANQD-UHFFFAOYSA-M- Molecular formula
- C22H22BrN6O4.Cl
- Average molar mass
- 549.8 g/mol
- Monoisotopic mass
- 548.05744
Names & identifiers
- Preferred name
- Pyridinium, 1-[2-[[4-[2-(2-bromo-4,6-dinitrophenyl)diazenyl]-3-methylphenyl]ethylamino]ethyl]-, chloride (1:1)
- IUPAC
- 4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-N-ethyl-3-methyl-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
- English name
- 1-[2-[[4-[(2-bromo-4,6-dinitrophenyl)azo]-m-tolyl]ethylamino]ethyl]pyridinium chloride
- Molecular formula
- C22H22BrN6O4.Cl
- Molecular weight
- 549.81
Names & synonyms
72361-40-1EINECS 276-597-9DTXSID208881401-(2-((4-((2-Bromo-4,6-dinitrophenyl)azo)-3-methylphenyl)ethylamino)ethyl)pyridinium chloridePyridinium, 1-(2-((4-((2-bromo-4,6-dinitrophenyl)azo)-3-methylphenyl)ethylamino)ethyl)-, chloridePyridinium, 1-(2-((4-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-3-methylphenyl)ethylamino)ethyl)-, chloride (1:1)Pyridinium, 1-[2-[[4-[(2-bromo-4,6-dinitrophenyl)azo]-3-methylphenyl]ethylamino]ethyl]-, chloridePyridinium, 1-[2-[[4-[2-(2-bromo-4,6-dinitrophenyl)diazenyl]-3-methylphenyl]ethylamino]ethyl]-, chloride (1:1)RefChem:177632DTXCID1010274221-(2-((4-((2-Bromo-4,6-dinitrophenyl)azo)-m-tolyl)ethylamino)ethyl)pyridinium chlorideBZSGZDPYHAANQD-UHFFFAOYSA-M
Show more names
1-[2-[[4-[(2-bromo-4,6-dinitrophenyl)azo]-m-tolyl]ethylamino]ethyl]pyridinium chloride1-[2-[[4-[(2-Bromo-4,6-dinitrophenyl)azo]-3-methylphenyl]ethylamino]ethyl] pyridinium chloride1-[2-[[4-[(2-Bromo-4,6-dinitrophenyl) azo]-3-methylphenyl]ethylamino]ethyl] pyridinium chloride
Properties
Computed structural properties
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 681
Physicochemical properties
- EPA Substance Registry System
- 1 · Pyridinium, 1-[2-[[4-[(2-bromo-4,6-dinitrophenyl)azo]-3-methylphenyl]ethylamino]ethyl]-, chloride (72361-40-1)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Pyridinium, 1-[2-[[4-[(2-bromo-4,6-dinitrophenyl)azo]-3-methylphenyl]ethylamino]ethyl]-, chloride
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPyridinium, 1-[2-[[4-[2-(2-bromo-4,6-dinitrophenyl)diazenyl]-3-methylphenyl]ethylamino]ethyl]-, chloride (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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