Vitas-M small molecule compound

1-(2-chloroethyl)-3-methyl-1H-pyrazole-4-carboxylic acid

Catalog ID
STK688572
SMILES ClCCn1nc(c(c1)C(=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 C7H9ClN2O2 MW 188.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H9ClN2O2/c1-5-6(7(11)12)4-10(9-5)3-2-8/h4H,2-3H2,1H3,(H,11,12)
InChIKey
VKPIDXVFERBENB-UHFFFAOYSA-N
Synonyms
956781-19-4
1(2chloroethyl)3methyl1Hpyrazole4carboxylicacid
1(2CHLOROETHYL)3METHYLPYRAZOLE4CARBOXYLICACID
1HPYRAZOLE4CARBOXYLICACID1(2CHLOROETHYL)3METHYL
956781194
CC1=NN(C=C1C(=O)O)CCCl
InChI=1SC7H9ClN2O2c156(7(11)12)410(95)328h4H23H21H3(H1112)
MFCD06809688
ZINC000004343424
ZINC4343424

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Available files

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