5-Triphenylmethyl-1H-tetrazole

C₂₀H₁₆N₄CAS 109652-10-0312.38 g/mol

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Properties

Molecular formula: C₂₀H₁₆N₄
Molar mass: 312.38 g/mol
Exact mass: 312.1375 Da
logP: 3.58Crippen estimate
Polar surface area: 54.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 4

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

109652-10-0

SMILES

c1ccc(C(c2ccccc2)(c2ccccc2)c2nn[nH]n2)cc1

InChIKey

ABPZRLQZVHPPCT-UHFFFAOYSA-N

InChI

InChI=1S/C20H16N4/c1-4-10-16(11-5-1)20(19-21-23-24-22-19,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H,21,22,23,24)

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Names and synonyms

3 names

5-(Triphenylmethyl)-2H-tetrazole
2H-Tetrazole, 5-(triphenylmethyl)-
Tetrazole, 5-trityl-

Work with 5-Triphenylmethyl-1H-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-Phenyltetrazole18039-42-445 % similar Tetraphenylmethane630-76-244 % similar 5-Benzyl-1H-tetrazole18489-25-341 % similar 5-Benzylthio-1H-tetrazole21871-47-638 % similar 5-(2-Bromophenyl)-2H-tetrazole73096-42-136 % similar 9,9-Diphenylfluorene20302-14-135 % similar 5-[4-(2H-Tetrazol-5-yl)phenyl]-2H-tetrazole6926-49-435 % similar 5-(2-Chlorophenyl)-2H-1,2,3,4-tetrazole50907-46-535 % similar

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

Same formula

Nitron487-88-7

Elsewhere

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