Vitas-M small molecule compound

1-methoxy-1-{3-methyl-3-[(2-methylbutan-2-yl)peroxy]but-1-yn-1-yl}cyclohexane

Catalog ID
STL570387
SMILES CCC(OOC(C#CC1(OC)CCCCC1)(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 C17H30O3 MW 282.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H30O3/c1-7-15(2,3)19-20-16(4,5)13-14-17(18-6)11-9-8-10-12-17/h7-12H2,1-6H3
InChIKey
QQDLYAAYBDIYHN-UHFFFAOYSA-N
Synonyms
158721-96-1
14968829
158721961
1methoxy1(3methyl3((2methylbutan2yl)peroxy)but1yn1yl)cyclohexane
1methoxy1(3methyl3(2methylbutan2ylperoxy)but1ynyl)cyclohexane
1methoxy1(3methyl3(tertpentylperoxy)but1yn1yl)cyclohexane
InChI=1SC17H30O3c1715(23)192016(45)131417(186)1198101217h712H216H3
MFCD01853816
ZINC000100699154

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Available files

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