Vitas-M small molecule compound

4-(ethoxycarbonyl)-1-methyl-1H-pyrazole-5-carboxylic acid

Catalog ID
STK351803
SMILES CCOC(=O)c1cnn(c1C(=O)O)C

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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 C8H10N2O4 MW 198.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H10N2O4/c1-3-14-8(13)5-4-9-10(2)6(5)7(11)12/h4H,3H2,1-2H3,(H,11,12)
InChIKey
INIPCPYOESSJQP-UHFFFAOYSA-N
Synonyms
81303-65-3
1HPYRAZOLE45DICARBOXYLICACID1METHYL4ETHYLESTER
2METHYL2HPYRAZOLE34DICARBOXYLICACID4ETHYLESTER
4(ethoxycarbonyl)1methyl1Hpyrazole5carboxylicacid
4(ETHOXYCARBONYL)1METHYLPYRAZOLE5CARBOXYLICACID
4(ETHOXYCARBONYL)2METHYLPYRAZOLE3CARBOXYLICACID
4ethoxycarbonyl2methylpyrazole3carboxylicacid
4ETHYLHYDROGEN1METHYL1HPYRAZOLE45DICARBOXYLATE
81303653
CCOC(=O)C1=C(N(N=C1)C)C(=O)O
InChI=1SC8H10N2O4c13148(13)54910(2)6(5)7(11)12h4H3H212H3(H1112)
MFCD09473474
ZINC000012396156
ZINC12396156

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Available files

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