Vitas-M small molecule compound

3-tert-butyl-5-(trifluoromethyl)-1H-pyrazole

Catalog ID
STK499921
SMILES CC(c1n[nH]c(c1)C(F)(F)F)(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 C8H11F3N2 MW 192.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11F3N2/c1-7(2,3)5-4-6(13-12-5)8(9,10)11/h4H,1-3H3,(H,12,13)
InChIKey
YIEPWAOKLZRBEL-UHFFFAOYSA-N
Synonyms
150433-22-0
150433220
1HPYRAZOLE3(11DIMETHYLETHYL)5(TRIFLUOROMETHYL)
3(tertbutyl)5(trifluoromethyl)1Hpyrazole
3(TERTBUTYL)5(TRIFLUOROMETHYL)PYRAZOLE
3tertbutyl5(trifluoromethyl)1Hpyrazole
3TERTBUTYL5(TRIFLUOROMETHYL)2HPYRAZOLE
3TERTBUTYL5TRIFLUOROMETHYL1HPYRAZOLE
5(2METHYL2PROPANYL)3(TRIFLUOROMETHYL)1HPYRAZOLE
5(TBUTYL)3(TRIFLUOROMETHYL)1HPYRAZOLE
5(TERTBUTYL)3(TRIFLUOROMETHYL)1HPYRAZOLE
5(TERTBUTYL)3(TRIFLUOROMETHYL)PYRAZOLE
5TERTBUTYL3(TRIFLUOROMETHYL)1HPYRAZOLE
5TERTBUTYL3(TRIFLUOROMETHYL)1HPYRAZOLE95
5TERTBUTYL3(TRIFLUOROMETHYL)PYRAZOLE
5TERTBUTYL3TRIFLUOROMETHYL1HPYRAZOLE
CC(C)(C)C1=NNC(=C1)C(F)(F)F
CC(c1n(nH)c(c1)C(F)(F)F)(C)C
InChI=1SC8H11F3N2c17(23)546(13125)8(910)11h4H13H3(H1213)
MFCD01050222
ZINC000004567311
ZINC04567311
ZINC4567311

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Available files

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