chempirical

Tetrazolium violet

C23H17ClN4CAS 1719-71-7384.87 g/mol

Open in Covalent MOL file
Cl−NNN+N

Properties

Molecular formula
C23H17ClN4
Molar mass
384.87 g/mol
Exact mass
384.1142 Da
logP
1.37Crippen estimate
Polar surface area
34.6 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
1719-71-7
SMILES
[Cl-].c1ccc(-c2nn(-c3ccccc3)[n+](-c3cccc4ccccc34)n2)cc1
InChIKey
RONADMZTCCPLEF-UHFFFAOYSA-M
InChI
InChI=1S/C23H17N4.ClH/c1-3-11-19(12-4-1)23-24-26(20-14-5-2-6-15-20)27(25-23)22-17-9-13-18-10-7-8-16-21(18)22;/h1-17H;1H/q+1;/p-1

Weigh it out

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Names and synonyms

12 names
  • 2H-Tetrazolium, 3-(1-naphthalenyl)-2,5-diphenyl-, chloride (1:1)
  • 2H-Tetrazolium, 3-(1-naphthyl)-2,5-diphenyl-, chloride
  • 2H-Tetrazolium, 3-(1-naphthalenyl)-2,5-diphenyl-, chloride
  • 3-(1-Naphthyl)-2,5-diphenyl-2H-tetrazolium chloride
  • Violet tetrazolium
  • 2,5-Diphenyl-3-(1-naphthyl)tetrazolium chloride
  • TV
  • 2,5-Diphenyl-3-α-naphthyltetrazolium chloride
  • Tetrazolium purple
  • Tetrazolium violet chloride
  • VT
  • 2,5-Diphenyl-3-(1-naphthyl)-2H-tetrazolium chloride

Work with Tetrazolium violet

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tetrazolium chloride298-96-464 % similar Blue tetrazolium1871-22-356 % similar 2,3,5-Triphenyltetrazolium bromide1096-80-653 % similar Nitro blue tetrazolium chloride298-83-943 % similar [3-(4,5-Dimethylthiazol-2-yl)-2,5-diphenyltetrazolium bromide]298-93-143 % similar Int (chemical)146-68-943 % similar Tetranitro blue tetrazolium1184-43-637 % similar 1-Phenylnaphthalene605-02-733 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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