Vitas-M small molecule compound

5-tert-butyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK501288
SMILES CC(C1=NNC(=O)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 C7H12N2O MW 140.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H12N2O/c1-7(2,3)5-4-6(10)9-8-5/h4H2,1-3H3,(H,9,10)
InChIKey
VDNOHRWEOSDGQX-UHFFFAOYSA-N
Synonyms
29211-68-5
29211685
3(TERTBUTYL)2PYRAZOLIN5ONE
3(TERTBUTYL)45DIHYDRO1HPYRAZOL5ONE
3TERTBUTYL14DIHYDROPYRAZOL5ONE
3TERTBUTYL1HPYRAZOL5(4H)ONE
3TERTBUTYL2PYRAZOLIN5ONE
3TERTBUTYL2PYRAZOLIN5ONE98
3TERTBUTYL45DIHYDRO1HPYRAZOL5ONE
5tertbutyl24dihydro3Hpyrazol3one
5TERTBUTYL24DIHYDROPYRAZOL3ONE
CC(C)(C)C1=NNC(=O)C1
InChI=1SC7H12N2Oc17(23)546(10)985h4H213H3(H910)
MFCD00051760
ZINC000100005887
ZINC100005887

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Available files

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