2-(5-but-3-yn-2-yloxy-4-chloro-2-fluoro-phenyl)-4,5,6,7-tetrahydroisoi ndole-1,3-dione
- CAS No.
- 84478-52-4
- Chemical Name:
- 2-(5-but-3-yn-2-yloxy-4-chloro-2-fluoro-phenyl)-4,5,6,7-tetrahydroisoi ndole-1,3-dione
- Synonyms
- S 23121;Flumipropyn;N-(4-Chloro-2-fluoro-5-((1-methyl-2-propynyl)oxy)phenyl)-3,4,5,6-tetrahydrophthalimide;2-(5-but-3-yn-2-yloxy-4-chloro-2-fluoro-phenyl)-4,5,6,7-tetrahydroisoi ndole-1,3-dione;1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluoro-5-((1-methyl-2-propynyl)oxy)phenyl)-4,5,6,7-tetrahydro-;1H-Isoindole-1,3(2H)-dione, 2-[4-chloro-2-fluoro-5-[(1-methyl-2-propyn-1-yl)oxy]phenyl]-4,5,6,7-tetrahydro-
- CBNumber:
- CB81261039
- Molecular Formula:
- C18H15ClFNO3
- Molecular Weight:
- 347.77
- MDL Number:
- MOL File:
- 84478-52-4.mol
| Melting point | 115-116 °C |
|---|---|
| Boiling point | 502.1±50.0 °C(Predicted) |
| Density | 1.39±0.1 g/cm3(Predicted) |
| pka | -2.30±0.20(Predicted) |
| FDA UNII | Y3E93Z8TUL |
2-(5-but-3-yn-2-yloxy-4-chloro-2-fluoro-phenyl)-4,5,6,7-tetrahydroisoi ndole-1,3-dione Chemical Properties,Uses,Production
Definition
ChEBI: 2-[5-(but-3-yn-2-yloxy)-4-chloro-2-fluorophenyl]-4,5,6,7-tetrahydro-1H-isoindole-1,3(2H)-dione is a dicarboximide that is 4,5,6,7-tetrahydro-1H-isoindole-1,3(2H)-dione in which the nitrogen has been substituted by a 5-(but-3-yn-2-yloxy)-4-chloro-2-fluorophenyl group. It is a dicarboximide, a terminal acetylenic compound, an aromatic ether, a member of monofluorobenzenes, a member of monochlorobenzenes and a pyrroline.
Metabolic pathway
The major urinary metabolites of flumipropyn by rats are found to be 4-chloro-2-fluoro-5-hydroxyaniline, its sulfate, and glucuronide, and the major fecal metabolites in addition to the parent compound are six sulfonic acid conjugates with a sulfonic acid group incorporated into the double bond of the 3,4,5,6- tetrahydrophthalimide moiety. No acetylated derivative of 4-chloro-2-fluoro-5-[(1-methyl-2-propynyl)oxy]aniline is identified in mammalian cytosol preparations in vitro.