96989-76-3

Basic information

• Product Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid
• Synonyms: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid;4-[(2-amino-3,5-dibromo-phenyl)methylamino]cyclohexan-1-ol;1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid with trans-4-[[(2-Amino-3,5-dibromophenyl)methyl]amino]cyclohexanol;Acebrophylline
• CAS NO: 96989-76-3
• Molecular Formula: C₉H₁₀N₄O₄*C₁₃H₁₈Br₂N₂O
• Molecular Weight: 616.3
• Mol File: 96989-76-3.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 468.6 °C at 760 mmHg
• Flash Point: 237.2 °C
• Appearance: /
• Vapor Pressure: 1.38E-09mmHg at 25°C
• Storage Temp.: Refrigerator
• Solubility: DMSO (Sparingly), Methanol (Slightly)
• CAS DataBase Reference: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid(96989-76-3)
• EPA Substance Registry System: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid(96989-76-3)

Safety Data

• Hazardous Substances Data: 96989-76-3(Hazardous Substances Data)

Usage

Uses

Acebrophylline can be utilized for adverse effect, pharmacological activity and biological study of effect of acebrophylline vs. sustained release theophylline in patients of chronic obstructive pulmonary disease

InChI:InChI=1/C13H18Br2N2O.C9H10N4O4/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h5-6,10-11,17-18H,1-4,7,16H2;4H,3H2,1-2H3,(H,14,15)

Upstream product

• 18683-91-5 ambroxol 
• 652-37-9 acefylline 

Relevant articles and documents

A PROCESS FOR THE PREPARATION OF ACEBROPHYLLINE

The present invention relates to an improved process for preparing Acebrophylline comprising preparing a reaction mixture of theophylline-7-acetate and ambroxol base in a non-polar solvent; heating said reaction mixture at a suitable temperature; and isolating Acebrophylline by filtration. The yield of Acebrophylline is between 95-98 % with a purity of 99%.