3H-Indolium, 3-(2-(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazinylidene)-1-methyl-2-phenyl-, chloride (1:1)
Basic information
- CAS
41025-67-6- Standard SMILES
Cn1nc[n+](C)c1N=Nc1c(-c2ccccc2)n(C)c2ccccc12.[Cl-]- InChIKey
CNKXSGBFDSBULR-UHFFFAOYSA-M- Molecular formula
- C19H19N6.Cl
- Average molar mass
- 366.8 g/mol
- Monoisotopic mass
- 366.1359723
Names & identifiers
- Preferred name
- 3H-Indolium, 3-(2-(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazinylidene)-1-methyl-2-phenyl-, chloride (1:1)
- IUPAC
- (2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)-(1-methyl-2-phenylindol-3-yl)diazene chloride
- English name
- 3-[(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono]-1-methyl-2-phenyl-3H-indolium chloride
- Molecular formula
- C19H19ClN6
- Molecular weight
- 366.85
Names & synonyms
41025-67-6EINECS 255-178-43H-Indolium, 3-((2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono)-1-methyl-2-phenyl-, chlorideDTXSID908858283-(1-Methyl-2-phenylindolyl-3-azo)-2,4-dimethyl-1,2,4-triazolium chloride3H-Indolium, 3-(2-(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazinylidene)-1-methyl-2-phenyl-, chloride (1:1)3H-Indolium, 3-[(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono]-1-methyl-2-phenyl-, chloride3H-Indolium, 3-[2-(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazinylidene]-1-methyl-2-phenyl-, chloride (1:1)RefChem:95807DTXCID3010251893-[(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono]-1-methyl-2-phenyl-3H-indolium chloride(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)-(1-methyl-2-phenylindol-3-yl)diazene;chloride
Show more names
Basic Yellow 25Calionic Yellow X-3RLCationic Yellow X-3RLC.I.Basic Yellow 25:C.I.11450
Properties
Computed structural properties
- Topological polar surface area
- 51.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 477
Physicochemical properties
- EPA Substance Registry System
- 3 H-Indolium, · 3H-Indolium, 3-[(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono]-1-methyl-2-phenyl-, chloride (41025-67-6)
- 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.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (4 of 4) of all reports.
Not Classified
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 3H-Indolium, 3-[(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono]-1-methyl-2-phenyl-, chloride
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3H-Indolium, 3-[2-(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazinylidene]-1-methyl-2-phenyl-, chloride (1:1): ACTIVE
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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