Vitas-M small molecule compound

5-tert-butyl-2-(2-methylprop-2-en-1-yl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK834303
SMILES CC(=C)CN1N=C(CC1=O)C(C)(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 C11H18N2O MW 194.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H18N2O/c1-8(2)7-13-10(14)6-9(12-13)11(3,4)5/h1,6-7H2,2-5H3
InChIKey
VGJXNPZYWAGCLQ-UHFFFAOYSA-N
Synonyms
300588-64-1
3(tertbutyl)1(2methylallyl)1Hpyrazol5(4H)one
3(TERTBUTYL)1(2METHYLPROP2ENYL)2PYRAZOLIN5ONE
300588641
3TERTBUTYL1(2METHYLPROP2EN1YL)45DIHYDRO1HPYRAZOL5ONE
5TERTBUTYL2(2METHYLALLYL)24DIHYDROPYRAZOL3ONE
5tertbutyl2(2methylprop2en1yl)24dihydro3Hpyrazol3one
5TERTBUTYL2(2METHYLPROP2ENYL)4HPYRAZOL3ONE
CC(=C)CN1C(=O)CC(=N1)C(C)(C)C
InChI=1SC11H18N2Oc18(2)71310(14)69(1213)11(34)5h167H225H3
MFCD00230487
ZINC000006363155
ZINC06363155
ZINC6363155

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Available files

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