chempirical

Sodium tolyltriazole

C7H6N3NaCAS 64665-57-2155.14 g/mol

Open in Covalent MOL file
N−NNNa+

Properties

Molecular formula
C7H6N3Na
Molar mass
155.14 g/mol
Exact mass
155.0459 Da
logP
-2.10Crippen estimate
Polar surface area
39.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
64665-57-2
SMILES
CC1=C2C(=CC=C1)[N-]N=N2.[Na+]
InChIKey
REERYFLJRPUSHT-UHFFFAOYSA-N
InChI
InChI=1S/C7H6N3.Na/c1-5-3-2-4-6-7(5)9-10-8-6;/h2-4H,1H3;/q-1;+1

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Names and synonyms

9 names
  • Wintrol T 50NA
  • Cobratec TT 85
  • Tolyltriazole sodium salt
  • Wintrol T 50
  • Methylbenzotriazole sodium salt
  • 1H-Benzotriazole, 6(or 7)-methyl-, sodium salt (1:1)
  • 1H-Benzotriazole, 4(or 5)-methyl-, sodium salt
  • Cobratec TT 50S
  • Cobratec 85

Work with Sodium tolyltriazole

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

5-Methylquinoxaline13708-12-836 % similar 8-Methylquinoline611-32-536 % similar 2,8-Dimethylquinoline1463-17-834 % similar 2-Hydrazino-4-methylbenzothiazole20174-68-933 % similar 4-Chloro-8-methylquinoline18436-73-233 % similar 2-Chloro-4-methylbenzothiazole3622-32-033 % similar 2,6-Dimethylanisole1004-66-632 % similar 1,2,3-Trimethylbenzene526-73-832 % similar

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

Elsewhere

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