150934-01-3

Basic information

• Product Name: 2,5-Morpholinedione,3-methyl-6-(1-methylethyl)-,(3R-trans)-(9CI)
• Synonyms: 2,5-Morpholinedione,3-methyl-6-(1-methylethyl)-,(3R-trans)-(9CI)
• CAS NO: 150934-01-3
• Molecular Formula: C8H13NO3
• Molecular Weight: 171.19
• Product Categories: ISOPROPYL
• Mol File: 150934-01-3.mol
• Article Data: 1

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 2,5-Morpholinedione,3-methyl-6-(1-methylethyl)-,(3R-trans)-(9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 2,5-Morpholinedione,3-methyl-6-(1-methylethyl)-,(3R-trans)-(9CI)(150934-01-3)
• EPA Substance Registry System: 2,5-Morpholinedione,3-methyl-6-(1-methylethyl)-,(3R-trans)-(9CI)(150934-01-3)

Safety Data

• Hazardous Substances Data: 150934-01-3(Hazardous Substances Data)

Usage

Appearance

White crystalline solid

Melting point

120-122°C

Uses

Pharmaceutical intermediate with potential applications in the synthesis of various drugs and biologically active molecules

Safety

Handle and store according to proper safety procedures to avoid hazardous exposure

Upstream product

• 27109-47-3 2-bromoisovaleryl chloride 

Relevant articles and documents

Synthesis, structure and antimicrobial activity of 6-(propan-2-yl)-3- methyl-morpholine-2,5-dione

Cyclodepsipeptides are known to exhibit a broad spectrum of biological activities and present a great potential for pharmacological application. A novel didepsipeptide member of the family, 6-(propan-2-yl)-3-methyl-morpholine- 2,5-dione, was synthesized and its structure was confirmed by IR, 1H and 13C NMR spectral data. The structure and relative stability of the diastereoisomers, tautomers and anionic derivatives of 6-(propan-2-yl)-3- methyl-morpholine-2,5-dione were studied by DFT. Different conditions were considered by calculations in gas phase at the B3LYP/6-311++G ** level and in polar medium utilizing PCM methods at the same level of theory. In all cases the keto forms were found to be more stable and this form should be expected to exist in real systems. Experimental evidence for this statement was found by the IR spectra measured in KBr, polar and nonpolar solvent. The IR spectroscopy was employed to monitor the formation of anion derivative of 6-(propan-2-yl)-3-methyl-morpholine-2,5-dione. The corresponding spectral and structural changes, accompanying the molecule → anion conversion were studied by IR spectra and DFT calculations. The 6-(propan-2-yl)-3-methyl-morpholine-2,5-dione showed antimicrobial activity against four of five tested bacterial strains, being the most effective against Escherichia coli.