Vitas-M small molecule compound

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

Catalog ID
STL570412
SMILES CCCCOP(=O)(C#CC(OOC(CC)(C)C)(C)C)OCCCC

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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 C18H35O5P MW 362.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H35O5P/c1-8-11-14-20-24(19,21-15-12-9-2)16-13-18(6,7)23-22-17(4,5)10-3/h8-12,14-15H2,1-7H3
InChIKey
TUJOGSCSORARFP-UHFFFAOYSA-N
Synonyms

1933837
1dibutoxyphosphoryl3methyl3(2methylbutan2ylperoxy)but1yne
dibutyl(3methyl3((2methylbutan2yl)peroxy)but1yn1yl)phosphonate
dibutyl(3methyl3(tertpentylperoxy)but1yn1yl)phosphonate
InChI=1SC18H35O5Pc1811142024(1921151292)161318(67)232217(45)103h8121415H217H3
MFCD01555847
ZINC000002317292

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Available files

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