Basic information
- CAS
72797-26-3- Standard SMILES
CN(Cc1ccccc1)c1ccc(N=Nc2scc[n+]2C)cc1.[Cl-]- InChIKey
AYTFBSHAPXBMGO-UHFFFAOYSA-M- Molecular formula
- C18H19ClN4S
- Average molar mass
- 358.9 g/mol
- Monoisotopic mass
- 358.1018955
Names & identifiers
- Preferred name
- Thiazolium, 3-methyl-2-[2-[4-[methyl(phenylmethyl)amino]phenyl]diazenyl]-, chloride (1:1)
- IUPAC
- N-benzyl-N-methyl-4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]aniline chloride
- English name
- 2-[[4-[benzylmethylamino]phenyl]azo]-3-methylthiazolium chloride
- Molecular formula
- C18H19ClN4S
- Molecular weight
- 358.89
Names & synonyms
72797-26-3EINECS 276-850-3DTXSID80888227Thiazolium, 2-((4-(N-methylbenzenemethamine)phenyl)azo)-3-methyl-, chlorideThiazolium, 3-methyl-2-(2-(4-(methyl(phenylmethyl)amino)phenyl)diazenyl)-, chloride (1:1)Thiazolium, 3-methyl-2-((4-(methyl(phenylmethyl)amino)phenyl)azo)-, chlorideThiazolium, 3-methyl-2-[[4-[methyl(phenylmethyl)amino]phenyl]azo]-, chlorideThiazolium, 3-methyl-2-[2-[4-[methyl(phenylmethyl)amino]phenyl]diazenyl]-, chloride (1:1)RefChem:189307DTXCID901027507SCHEMBL4017323SCHEMBL4017326
Show more names
2-[[4-[benzylmethylamino]phenyl]azo]-3-methylthiazolium chloride3-methyl-2-[[4-[methyl(phenylmethyl)amino]phenyl]azo]-thiazoliu chlorideThiazolium,3-methyl-2-[[4-[methyl(phenylmethyl)amino]phenyl]azo]-,chlorideThiazolium, 2-[[4-(N-methylbenzenemethamine)phenyl]azo]-3-methyl-, chloride
SCHEMBL4017329AYTFBSHAPXBMGO-UHFFFAOYSA-MNS000909592-((4-(Benzylmethylamino)phenyl)azo)-3-methylthiazolium chloride2-({4-[Benzyl(methyl)amino]phenyl}diazenyl)-3-methyl-1,3-thiazol-3-ium chloride
Database identifiers
- CAS
72797-26-3- PubChem CID
- 175172
- DTXSID
DTXSID80888227- EC Number
- 276-850-3
Properties
Computed structural properties
- Topological polar surface area
- 60.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 375
Physicochemical properties
- EPA Substance Registry System
- 3 · Thiazolium, 3-methyl-2-[[4-[methyl(phenylmethyl)amino]phenyl]azo]-, chloride (72797-26-3)
- 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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationThiazolium, 3-methyl-2-[2-[4-[methyl(phenylmethyl)amino]phenyl]diazenyl]-, chloride (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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