Vitas-M small molecule compound

1-(butan-2-yl)-1H-pyrazole-5-carboxylic acid

Catalog ID
STK350119
SMILES CCC(n1nccc1C(=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 C8H12N2O2 MW 168.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H12N2O2/c1-3-6(2)10-7(8(11)12)4-5-9-10/h4-6H,3H2,1-2H3,(H,11,12)
InChIKey
KCQPLWZBEBFRJF-UHFFFAOYSA-N
Synonyms
1006451-49-5
1(butan2yl)1Hpyrazole5carboxylicacid
1(METHYLPROPYL)PYRAZOLE5CARBOXYLICACID
1006451495
1SECBUTYL1HPYRAZOLE5CARBOXYLICACID
2butan2ylpyrazole3carboxylicacid
CCC(C)N1C(=CC=N1)C(=O)O
InChI=1SC8H12N2O2c136(2)107(8(11)12)45910h46H3H212H3(H1112)
MFCD06805233
ZINC000012357786
ZINC000012357787

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Available files

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