Vitas-M small molecule compound

phenyl(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)methanone

Catalog ID
STK064286
SMILES O=C(N1N=C(CC1(C)C)C)c1ccccc1

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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 C13H16N2O MW 216.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O/c1-10-9-13(2,3)15(14-10)12(16)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey
VNANOPQDFPYYLB-UHFFFAOYSA-N
Synonyms
4590-79-8
1BENZOYL355TRIMETHYL45DIHYDRO1HPYRAZOLE
4590798
CC1=NN(C(C1)(C)C)C(=O)C2=CC=CC=C2
InChI=1SC13H16N2Oc110913(23)15(1410)12(16)117546811h48H9H213H3
MFCD00682547
O=C(N1N=C(CC1(C)C)C)c1ccccc1
PHENYL(355TRIMETHYL45DIHYDRO1HPYRAZOL1YL)METHANONE
PHENYL(355TRIMETHYL45DIHYDROPYRAZOL1YL)METHANONE
PHENYL(355TRIMETHYL4HPYRAZOL1YL)METHANONE
STK064286
ZINC000000328143
ZINC00328143
ZINC328143

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Available files

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