Vitas-M small molecule compound
3-(4-ethylphenyl)-1H-pyrazole-4-carboxylic acid
Catalog ID
STL291431
SMILES CCc1ccc(cc1)c1n[nH]cc1C(=O)O
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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 C12H12N2O2 MW 216.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O2/c1-2-8-3-5-9(6-4-8)11-10(12(15)16)7-13-14-11/h3-7H,2H2,1H3,(H,13,14)(H,15,16)InChIKey
PTMAQEKNSGRYGK-UHFFFAOYSA-NSynonyms
1015870-60-61015870606
3(4ethylphenyl)1Hpyrazole4carboxylicacid
5(4ethylphenyl)1Hpyrazole4carboxylicacid
CCC1=CC=C(C=C1)C2=C(C=NN2)C(=O)O
CCc1ccc(cc1)c1n(nH)cc1C(=O)O
InChI=1SC12H12N2O2c128359(648)1110(12(15)16)7131411h37H2H21H3(H1314)(H1516)
MFCD11190925
ZINC000009189792
ZINC9189792
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