Vitas-M small molecule compound

1-(3,5-dimethyl-1H-pyrazol-1-yl)-3-phenylpropan-1-one

Catalog ID
STK066052
SMILES Cc1nn(c(c1)C)C(=O)CCc1ccccc1

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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/c1-11-10-12(2)16(15-11)14(17)9-8-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3
InChIKey
KGKSYAQJNOLMMM-UHFFFAOYSA-N
Synonyms

1(35DIMETHYL1HPYRAZOL1YL)3PHENYL1PROPANONE
1(35DIMETHYL1HPYRAZOL1YL)3PHENYLPROPAN1ONE
1(35DIMETHYLPYRAZOL1YL)3PHENYLPROPAN1ONE
1(35DIMETHYLPYRAZOLYL)3PHENYLPROPAN1ONE
35DIMETHYL1(3PHENYLPROPANOYL)1HPYRAZOLE
CC1=CC(=NN1C(=O)CCC2=CC=CC=C2)C
Cc1nn(c(c1)C)C(=O)CCc1ccccc1
InChI=1SC14H16N2Oc1111012(2)16(1511)14(17)98136435713h3710H89H212H3
MFCD01173315
STK066052
ZINC000000587021
ZINC00587021
ZINC587021

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Available files

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