Vitas-M small molecule compound

4-(1H-tetrazol-1-yl)benzoic acid

Catalog ID
STK386525
SMILES OC(=O)c1ccc(cc1)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/c13-8(14)6-1-3-7(4-2-6)12-5-9-10-11-12/h1-5H,(H,13,14)
InChIKey
DNFUQGMGGZFYPL-UHFFFAOYSA-N
Synonyms
78190-05-3
1(4CARBOXYPHENYL)1HTETRAZOLE
4(1HTETRAAZOL1YL)BENZOICACID
4(1HTETRAZOL1YL)BENZOICACID
4(1TETRAZOLYL)BENZOICACID
4(TETRAZOL1YL)BENZOICACID
4TETRAZOL1YLBENZOICACID
4TETRAZOLYLBENZOICACID
78190053
BENZOICACID4(1HTETRAZOL1YL)
C1=CC(=CC=C1C(=O)O)N2C=NN=N2
InChI=1SC8H6N4O2c138(14)6137(426)1259101112h15H(H1314)
MFCD00574246
ZINC000000036461
ZINC36461

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Available files

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