Vitas-M small molecule compound

2-(3,4-dimethylphenyl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one

Catalog ID
STK625357
SMILES CCCc1[nH]n(c(=O)c1)c1ccc(c(c1)C)C

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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 C14H18N2O MW 230.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O/c1-4-5-12-9-14(17)16(15-12)13-7-6-10(2)11(3)8-13/h6-9,15H,4-5H2,1-3H3
InChIKey
VDAMTDUWIQSMCZ-UHFFFAOYSA-N
Synonyms
925067-98-7
1(34DIMETHYLPHENYL)3PROPYLPYRAZOL5OL
2(34dimethylphenyl)5propyl12dihydro3Hpyrazol3one
2(34dimethylphenyl)5propyl1Hpyrazol3one
925067987
CCCc1(nH)n(c(=O)c1)c1ccc(c(c1)C)C
CCCC1=CC(=O)N(N1)C2=CC(=C(C=C2)C)C
InChI=1SC14H18N2Oc14512914(17)16(1512)137610(2)11(3)813h6915H45H213H3
MFCD09793654
ZINC000009477229
ZINC09477229
ZINC100072161
ZINC9477229

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Available files

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