81250-17-1

Basic information

• Product Name: 1-Allyl-3-isobutyl-8-methylxanthine
• Synonyms: 1-Allyl-3-isobutyl-8-methylxanthine
• CAS NO: 81250-17-1
• Molecular Formula: C13H18N4O2
• Molecular Weight: 262.3076
• Mol File: 81250-17-1.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 480.8°Cat760mmHg
• Flash Point: 244.6°C
• Appearance: /
• Density: 1.195g/cm³
• Vapor Pressure: 2.11E-09mmHg at 25°C
• Refractive Index: 1.558
• CAS DataBase Reference: 1-Allyl-3-isobutyl-8-methylxanthine(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Allyl-3-isobutyl-8-methylxanthine(81250-17-1)
• EPA Substance Registry System: 1-Allyl-3-isobutyl-8-methylxanthine(81250-17-1)

Safety Data

• Hazardous Substances Data: 81250-17-1(Hazardous Substances Data)

Usage

InChI:InChI=1/C13H18N4O2/c1-5-6-16-12(18)10-11(15-9(4)14-10)17(13(16)19)7-8(2)3/h5,8H,1,6-7H2,2-4H3,(H,14,15)

Relevant articles and documents

Di- or trisubstituted xanthines with neuroleptic properties and composition

The invention relates to xanthines corresponding to the formula STR1 and physiologically acceptable salts thereof, in which R1 represents C2 -C4 -alkyl, C3 -C4 -isoalkyl, CH2 -(C2 -C3 -alkenyl) or CH2 -(C3 -isoalkenyl); R3 represents C3 -C5 -alkyl, C3 -C5 -isoalkyl, CH2 -(C2 -C4 -alkenyl) or CH2 -(C3 -C4 -isoalkenyl); R8 represents H, methyl or ethyl; with the proviso that (1) when R8 represents H, R1 is allyl and (2) R1 and R3 cannot both represent butyl or allyl at the same time. The compounds show non-specific or anxiolytic sedative activity.