Vitas-M small molecule compound

1-(1,3-benzodioxol-5-yl)-1H-tetrazole

Catalog ID
STK386313
SMILES C1Oc2c(O1)cc(cc2)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 C8H6N4O2 MW 190.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6N4O2/c1-2-7-8(14-5-13-7)3-6(1)12-4-9-10-11-12/h1-4H,5H2
InChIKey
GYJHORVHVFLLGL-UHFFFAOYSA-N
Synonyms
326874-59-3
1(13BENZODIOXOL5YL)1HTETRAAZOLE
1(13BENZODIOXOL5YL)1HTETRAZOLE
1(13BENZODIOXOL5YL)TETRAZOLE
326874593
C1OC2=C(O1)C=C(C=C2)N3C=NN=N3
InChI=1SC8H6N4O2c1278(145137)36(1)1249101112h14H5H2
MFCD02703652
ZINC000003183512
ZINC03183512
ZINC3183512

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Available files

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