Vitas-M small molecule compound

methyl 4-ethynyl-1-methyl-1H-pyrazole-3-carboxylate

Catalog ID
STL415160
SMILES COC(=O)c1nn(cc1C#C)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 C8H8N2O2 MW 164.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H8N2O2/c1-4-6-5-10(2)9-7(6)8(11)12-3/h1,5H,2-3H3
InChIKey
WONDBSBPEJBIOM-UHFFFAOYSA-N
Synonyms
1354704-40-7
1354704407
CN1C=C(C(=N1)C(=O)OC)C#C
InChI=1SC8H8N2O2c146510(2)97(6)8(11)123h15H23H3
methyl4ethynyl1methyl1Hpyrazole3carboxylate
methyl4ethynyl1methylpyrazole3carboxylate
MFCD24540296
ZINC000072336350
ZINC72336350

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Available files

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