Vitas-M small molecule compound

(2E)-3-(4-methylphenyl)-1-(1H-pyrazol-1-yl)prop-2-en-1-one

Catalog ID
STK440902
SMILES Cc1ccc(cc1)/C=C/C(=O)n1cccn1

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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 C13H12N2O MW 212.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2O/c1-11-3-5-12(6-4-11)7-8-13(16)15-10-2-9-14-15/h2-10H,1H3/b8-7+
InChIKey
XGVMPRUZCIDYMA-BQYQJAHWSA-N
Synonyms
544439-84-1
(2E)3(4methylphenyl)1(1Hpyrazol1yl)prop2en1one
(2E)3(4METHYLPHENYL)1PYRAZOLYLPROP2EN1ONE
(E)3(4METHYLPHENYL)1PYRAZOL1YLPROP2EN1ONE
1(3(4METHYLPHENYL)ACRYLOYL)1HPYRAZOLE
544439841
CC1=CC=C(C=C1)C=CC(=O)N2C=CC=N2
Cc1ccc(cc1)C=CC(=O)n1cccn1
InChI=1SC13H12N2Oc1113512(6411)7813(16)1510291415h210H1H3b87+
MFCD03377918
ZINC000004614262
ZINC04614262
ZINC4614262

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Available files

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