Vitas-M small molecule compound

3-(1H-tetrazol-1-yl)benzonitrile

Catalog ID
STL433274
SMILES N#Cc1cccc(c1)n1cnnn1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C8H5N5 MW 171.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H5N5/c9-5-7-2-1-3-8(4-7)13-6-10-11-12-13/h1-4,6H
InChIKey
PKRSGNRLLIKPLT-UHFFFAOYSA-N
Synonyms
1291486-07-1
1291486071
3(1HTETRAAZOL1YL)BENZONITRILE
3(1Htetrazol1yl)benzonitrile
3(tetrazol1yl)benzonitrile
C1=CC(=CC(=C1)N2C=NN=N2)C#N
InChI=1SC8H5N5c9572138(47)13610111213h146H
MFCD23703718
ZINC000065336714
ZINC65336714

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.