Vitas-M small molecule compound

3-benzyl-5-tert-butyl-1H-pyrazole

Catalog ID
STK085674
SMILES CC(c1[nH]nc(c1)Cc1ccccc1)(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 C14H18N2 MW 214.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2/c1-14(2,3)13-10-12(15-16-13)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3,(H,15,16)
InChIKey
WQKMACGRTRICNN-UHFFFAOYSA-N
Synonyms
300589-07-5
300589075
3benzyl5(tertbutyl)1Hpyrazole
3benzyl5tertbutyl1Hpyrazole
5(TERTBUTYL)3BENZYLPYRAZOLE
5BENZYL3TERTBUTYL1HPYRAZOLE
CC(C)(C)C1=NNC(=C1)CC2=CC=CC=C2
CC(c1(nH)nc(c1)Cc1ccccc1)(C)C
InChI=1SC14H18N2c114(23)131012(151613)9117546811h4810H9H213H3(H1516)
MFCD00760712
STK085674
ZINC000018137380
ZINC18137380

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Available files

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