Vitas-M small molecule compound

1-[4-(1H-tetrazol-5-ylmethyl)phenyl]-1H-tetrazole

Catalog ID
STL388733
SMILES n1nnn(c1)c1ccc(cc1)Cc1[nH]nnn1

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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 C9H8N8 MW 228.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N8/c1-3-8(17-6-10-13-16-17)4-2-7(1)5-9-11-14-15-12-9/h1-4,6H,5H2,(H,11,12,14,15)
InChIKey
LVPSMSMYEBBENY-UHFFFAOYSA-N
Synonyms

1(4(1Htetrazol5ylmethyl)phenyl)1Htetrazole
1(4(2Htetrazol5ylmethyl)phenyl)tetrazole
C1=CC(=CC=C1CC2=NNN=N2)N3C=NN=N3
InChI=1SC9H8N8c138(17610131617)427(1)59111415129h146H5H2(H11121415)
MFCD09163039
n1nnn(c1)c1ccc(cc1)Cc1(nH)nnn1
ZINC000010336165
ZINC10336165

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Available files

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