Vitas-M small molecule compound

(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)acetic acid

Catalog ID
STL163890
SMILES CCc1c(C)nn(c1C)CC(=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 C9H14N2O2 MW 182.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H14N2O2/c1-4-8-6(2)10-11(7(8)3)5-9(12)13/h4-5H2,1-3H3,(H,12,13)
InChIKey
IKHKKHQEJQBWPK-UHFFFAOYSA-N
Synonyms
1177352-85-0
(4ethyl35dimethyl1Hpyrazol1yl)aceticacid
(4ETHYL35DIMETHYLPYRAZOL1YL)ACETICACID
1177352850
2(4ETHYL35DIMETHYL1HPYRAZOL1YL)ACETICACID
2(4ethyl35dimethylpyrazol1yl)aceticacid
CCC1=C(N(N=C1C)CC(=O)O)C
InChI=1SC9H14N2O2c1486(2)1011(7(8)3)59(12)13h45H213H3(H1213)
MFCD12030897
ZINC000034925286
ZINC34925286

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Available files

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