Vitas-M small molecule compound

(3,5-di-tert-butyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl)(phenyl)methanone

Catalog ID
STK369990
SMILES O=C(N1N=C(CC1(O)C(C)(C)C)C(C)(C)C)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 C18H26N2O2 MW 302.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O2/c1-16(2,3)14-12-18(22,17(4,5)6)20(19-14)15(21)13-10-8-7-9-11-13/h7-11,22H,12H2,1-6H3
InChIKey
LXEPHADHRTZNCT-UHFFFAOYSA-N
Synonyms

(35ditertbutyl5hydroxy45dihydro1Hpyrazol1yl)(phenyl)methanone
(35DITERTBUTYL5HYDROXY45DIHYDROPYRAZOL1YL)PHENYLMETHANONE
(35DITERTBUTYL5HYDROXY4HPYRAZOL1YL)PHENYLMETHANONE
35BIS(TERTBUTYL)5HYDROXY(2PYRAZOLINYL)PHENYLKETONE
CC(C)(C)C1=NN(C(C1)(C(C)(C)C)O)C(=O)C2=CC=CC=C2
InChI=1SC18H26N2O2c116(23)141218(2217(45)6)20(1914)15(21)13108791113h71122H12H216H3
MFCD00403882
ZINC000000276560
ZINC000000276561

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Available files

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