Vitas-M small molecule compound

3,5-dimethyl-1H-pyrazole-4-sulfonate

Catalog ID
STK094566
SMILES Cc1[nH]nc(c1S(=O)(=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 C5H7N2O3S MW 175.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H8N2O3S/c1-3-5(11(8,9)10)4(2)7-6-3/h1-2H3,(H,6,7)(H,8,9,10)/p-1
InChIKey
XWDFGELFGLFBNB-UHFFFAOYSA-M
Synonyms

35DIMETHYL1HPYRAZOLE4SULFONATE
35DIMETHYL1HPYRAZOLE4SULFONICACIDANION
Cc1(nH)nc(c1S(=O)(=O)(O))C
CC1=C(C(=NN1)C)S(=O)(=O)(O)
InChI=1SC5H8N2O3Sc135(11(89)10)4(2)763h12H3(H67)(H8910)p1
MFCD00462193
STK094566
ZINC000002810141
ZINC02810141

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Available files

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