Vitas-M small molecule compound

2-phenyl-1-(1H-pyrazol-1-yl)butan-1-one

Catalog ID
STK441678
SMILES CCC(C(=O)n1cccn1)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 C13H14N2O MW 214.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O/c1-2-12(11-7-4-3-5-8-11)13(16)15-10-6-9-14-15/h3-10,12H,2H2,1H3
InChIKey
GNVJCCFXOWCKFS-UHFFFAOYSA-N
Synonyms

2phenyl1(1Hpyrazol1yl)butan1one
2PHENYL1PYRAZOL1YLBUTAN1ONE
2PHENYL1PYRAZOLYLBUTAN1ONE
CCC(C1=CC=CC=C1)C(=O)N2C=CC=N2
InChI=1SC13H14N2Oc1212(117435811)13(16)1510691415h31012H2H21H3
MFCD01349482
ZINC000000474070
ZINC000000474071

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Available files

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