chempirical

5-Methyl-2H-tetrazole

C2H4N4CAS 4076-36-284.08 g/mol

Open in Covalent MOL file
NNNHN

Properties

Molecular formula
C2H4N4
Molar mass
84.08 g/mol
Exact mass
84.0436 Da
Melting point
145–146 °C
logP
-0.49Crippen estimate
Polar surface area
54.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Identifiers

CAS number
4076-36-2
SMILES
Cc1nn[nH]n1
InChIKey
XZGLNCKSNVGDNX-UHFFFAOYSA-N
InChI
InChI=1S/C2H4N4/c1-2-3-5-6-4-2/h1H3,(H,3,4,5,6)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • 2H-Tetrazole, 5-methyl-
  • 1H-Tetrazole, 5-methyl-
  • 5-Methyltetrazole
  • 5-Methyl-1,2,3,4-tetrazole
  • T 2588F
  • 5-Methyl-1H-tetrazole
  • NSC 11136
  • M 5T

Work with 5-Methyl-2H-tetrazole

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-Methylthio-1H-tetrazole29515-99-940 % similar 5-(4-Methylphenyl)-2H-tetrazole24994-04-538 % similar 5-Ethylthio-1H-tetrazole89797-68-236 % similar 5-Phenyltetrazole18039-42-432 % similar 5-(2-Chloroethyl)-2H-tetrazole18755-46-932 % similar 3-Methyl-1,2,4-triazole7170-01-632 % similar 5-(4′-Methyl-1,1′-biphenyl-2-yl)-1H-tetrazole120568-11-831 % similar 5-(4-Methoxyphenyl)-2H-tetrazole6926-51-830 % similar

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

Same formula

2-Cyanoguanidine461-58-5 4-Amino-1,2,4-triazole584-13-4 3-Amino-1,2,4-triazole61-82-5

Elsewhere

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