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CAS No 4499-40-5 , 1,3-dimethyl-2-oxopurin-6-olate

  • Name: 1,3-dimethyl-2-oxopurin-6-olate
  • Synonyms: SureCN4629; Choline theophylline; Theocolin (TN); 4499-40-5;1,3-dimethyl-2-oxopurin-6-olate;Choledyl; AC1LCVCP; Theocolin; Oxtriphylline (USP); OXTRIPHYLLINE;2-hydroxyethyl(trimethyl)azanium;
  • CAS Registry Number:
  • Flash Point: 228.4°C
  • Boiling Point: 454.1°Cat760mmHg
  • Density: g/cm3
  • Safety Statements: Poison by ingestion, intravenous, intraperitoneal, and intramuscular routes. Human systemic effects by ingestion: changes in potassium, changes in urine composition, hyperglycemia, metabolic acidosis, nausea or vomiting, tremors, and excitement. When heated to decomposition it emits toxic fumes of NOx and NH3. See also CHOLINE.
  • Flash Point: 228.4°C
  • EINECS: 224-798-7
  • Molecular Weight: 283.32684
  • InchiKey: SOELXOBIIIBLRJ-UHFFFAOYSA-M
  • InChI: InChI=1S/C7H8N4O2.C5H14NO/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;1-6(2,
    3)4-5-7/h3,12H,1-2H3;7H,4-5H2,1-3H3/q;+1/p-1
  • Molecular Formula: C12H21N5O3
  • Molecular Structure:CAS No:4499-40-5 1,3-dimethyl-2-oxopurin-6-olate

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References of 1,3-dimethyl-2-oxopurin-6-olate
Title: Choline Theophyllinate
CAS Registry Number: 4499-40-5
CAS Name: 2-Hydroxy-N,N,N-trimethylethanaminium salt with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
Synonyms: theophylline cholinate; theophylline salt of choline; oxtriphylline; oxytrimethylline
Trademarks: Sabidal (Zyma); Teokolin; Teofilcolina; Filoral; Cholinophylline; Choledyl (Warner-Chilcott); Theoxylline; Soliphylline
Molecular Formula: C12H21N5O3
Molecular Weight: 283.33
Percent Composition: C 50.87%, H 7.47%, N 24.72%, O 16.94%
Literature References: Prepn: Ladenburg et al., US 2776287 (1957 to Nepera Chem.).
Properties: White granules (contains about 60% of anhydr theophylline). One gram dissolves in 1 ml water.
NOTE: Also sold as Cholinophylline Magnesium Glycinate which contains 43% of anhydr theophylline.
Therap-Cat: Bronchodilator.
Keywords: Bronchodilator; Xanthine Derivatives.