Vitas-M small molecule compound

1-butyl-1H-pyrazole-5-carboxylic acid

Catalog ID
STK350117
SMILES CCCCn1nccc1C(=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 C8H12N2O2 MW 168.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H12N2O2/c1-2-3-6-10-7(8(11)12)4-5-9-10/h4-5H,2-3,6H2,1H3,(H,11,12)
InChIKey
GPCNIDIHJOJQFF-UHFFFAOYSA-N
Synonyms
1006493-81-7
1006493817
1butyl1Hpyrazole5carboxylicacid
1BUTYLPYRAZOLE5CARBOXYLICACID
2butylpyrazole3carboxylicacid
CCCCN1C(=CC=N1)C(=O)O
InChI=1SC8H12N2O2c1236107(8(11)12)45910h45H236H21H3(H1112)
MFCD06805232
ZINC000012357785
ZINC12357785

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Available files

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