Vitas-M small molecule compound

1-(4-methyl-1H-pyrazol-1-yl)-2-phenylbutan-1-one

Catalog ID
STK463343
SMILES CCC(C(=O)n1ncc(c1)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 C14H16N2O MW 228.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O/c1-3-13(12-7-5-4-6-8-12)14(17)16-10-11(2)9-15-16/h4-10,13H,3H2,1-2H3
InChIKey
IEKUZIDGEDGMOP-UHFFFAOYSA-N
Synonyms

1(4methyl1Hpyrazol1yl)2phenylbutan1one
1(4METHYLPYRAZOL1YL)2PHENYLBUTAN1ONE
1(4METHYLPYRAZOLYL)2PHENYLBUTAN1ONE
CCC(C1=CC=CC=C1)C(=O)N2C=C(C=N2)C
InChI=1SC14H16N2Oc1313(127546812)14(17)161011(2)91516h41013H3H212H3
MFCD06004466
ZINC000001054343
ZINC000001054345

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Available files

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