ChemicalBook--->CAS DataBase List--->4499-40-5

4499-40-5

4499-40-5 Structure

4499-40-5 Structure
IdentificationBack Directory
[Name]

CHOLINE THIEOPHYLLINATE
[CAS]

4499-40-5
[Synonyms]

Sabidal
Teovent
filoral
Zy-15061
teokolin
choledyl
cholegyl
Bronchodil
Sabidal SR
theoxylline
soliphylline
teofilcolina
OXTRIPHYLLINE
choledylsa400
cholinophylline
oxtrimethylline
Oxytrimethylline
OXTRIPHYLLINE,USP
choline theophylline
ChOIiniTheophyllinas
theophyllinecholinate
CalcliumTheophylineate
-purine-2,6-dione(1:1)
Oxtriphylline (500 mg)
CHOLINE THIEOPHYLLINATE
cholinetheophyllinesalt
theophyllinesaltofcholine
RLANKEDHRWMNRO-UHFFFAOYSA-M
CHOLINE THIEOPHYLLINATE USP/EP/BP
choline,compd.withtheophylline(1:1)
(2-hydroxyethyl)trimethylammoniumcompoundwiththeophylline
1,3-dimethyl-2-oxopurin-6-olate,2-hydroxyethyl(trimethyl)azanium
ethanaminium,2-hydroxy-n,n,n-trimethyl-,saltwith3,7-dihydro-1,3-dimethylp
ethanaminium,2-hydroxy-n,n,n-trimethyl-,saltwith3,7-dihydro-1,3-dimethyl-1h
2-hydroxy-N,N,N-trimethylethanaminium 1,3-dimethyl-2-oxo-2,3-dihydro-1H-purin-6-olate
2-Hydroxy-N,N,N-trimethylethanaminium salt with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
[EINECS(EC#)]

224-798-7
[Molecular Formula]

C12H21N5O3
[MDL Number]

MFCD00236001
[MOL File]

4499-40-5.mol
[Molecular Weight]

283.33
Chemical PropertiesBack Directory
[Melting point ]

176-178 °C
[storage temp. ]

Store at -20°C
[solubility ]

PBS (pH 7.2): 10 mg/ml
[form ]

A crystalline solid
[color ]

White to off-white
[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/h3H,1-2H3,(H,8,9,12);7H,4-5H2,1-3H3/q;+1/p-1
[InChIKey]

RLANKEDHRWMNRO-UHFFFAOYSA-M
[SMILES]

C12[N-]C=NC=1N(C)C(=O)N(C)C2=O.[N+](C)(C)(C)CCO
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Choline hydroxide-->Theophylline-->Choline bicarbonate
Safety DataBack Directory
[HS Code ]

2939590000
Hazard InformationBack Directory
[Chemical Properties]

White crystalline powder. Melting point 187-192°C. Soluble in water, ethanol, slightly soluble in ether and chloroform. Has a slight amine odor and a salty and bitter taste.
[Originator]

Sabidal ,S.R. Zyma, UK ,1983
[Uses]

Bronchodilator.
[Manufacturing Process]

18 parts by weight of theophylline are added to 37.8 parts by weight of aqueous choline bicarbonate (47% assay) and the mixture stirred and heated at 80°C to 90°C until the evolution of carbon dioxide has ceased and complete solution effected. Water is separated from the reaction mixture by distillation under a vacuum sufficient to keep the still temperature between 50°C and 55 C. After about 95 parts by weight of water have been separated, about 80 parts by weight of isopropyl alcohol are added and the mixture subjected to further distillation under a vacuum sufficient to keep the mixture boiling at about 40°C. The distillation removes some of the water as an azeotrope with the isopropyl alcohol. During the removal of the water-isopropyl alcohol azeotrope a crystalline precipitate forms. The mixture is further cooled slowly to 5°C and the crystalline precipitate filtered off. The choline theophyllinate crystals are then washed with isopropyl alcohol and dried under vacuum at about 70°C. A second crop of the product may be obtained from the mother liquor by further reduction in volume and cooling. A yield of 90.5% of theory of choline theophyllinate is obtained completely free of inorganic salts.
[Brand name]

Choledyl(Parke-Davis).
[Therapeutic Function]

Smooth muscle relaxant
[storage]

Store at -20°C
4499-40-5 suppliers list
Company Name: Youhua Pharmaceutical (Leshan) Co., Ltd.  Gold
Telephone: 0833-2595508
Website: www.chemicalbook.com/ShowSupplierProductsList184971/0_EN.htm
Company Name: Sinopharm Chemical Reagent Co,Ltd.  
Telephone: 86-21-63210123
Website: www.reagent.com.cn
Company Name: Spectrum Chemical Manufacturing Corp.  
Telephone: 021-021-021-67601398-809-809-809 15221380277
Website: www.spectrumchemical.com/oa_html/index.jsp?minisite=10020&respid=22372&language=us
Company Name: Hubei XinyuanShun Chemical Co., Ltd.  
Telephone: 13971561712, 13995564702, 027-50664929
Website: www.chemicalbook.com/ShowSupplierProductsList16209/0_EN.htm
Company Name: Shanghai YuanYe Biotechnology Co., Ltd.  
Telephone: 15026964105
Website: www.shyuanye.com
Company Name: Wuhan Wsem Biological Co., Ltd.  
Telephone: 027-83778876; 13667159345
Website: http://wsem.com.cn
Company Name: JinJin Le Chemical Co., Ltd  
Telephone: 18001959627(微信同号) 18001959627
Website: http://www.jinjinlechem.com
Company Name: Wuhan FengyaoTonghui Chemical Products Co., Ltd.  
Telephone: 027-87466105 15377573527
Website: www.chemicalbook.com/ShowSupplierProductsList30440/0_EN.htm
Company Name: Shanghai Hongye Biotechnology Co. Ltd  
Telephone: 400-9205774 400-920-5774
Website: www.glpbio.cn
Company Name: Qiuxian Baitai New Material Co., LTD  
Telephone: +86-19932103556
Website: https://www.chemicalbook.com/manufacturer/qiuxian-baitai-new-material-384/
Company Name: Dayang Chem (Hangzhou) Co.,Ltd.  
Telephone: +86-0571-88938639 17705817739
Website: www.dycnchem.com/
Company Name: Xi'an ZB Biotech Co.,Ltd  
Telephone:
Website: www.xazbbio.cn
Company Name: Dideu Industries Group Limited  
Telephone: +8617392712697
Website: www.dideu.com
Company Name: AFINE CHEMICALS LIMITED  
Telephone: +86-571-85134551 +86-18958018566
Website: www.afinechem.com/index.html
Company Name: Chongqing Chemdad Co., Ltd  
Telephone: +86-023-6139-8061 +86-86-13650506873
Website: http://www.chemdad.com/
Company Name: Wuhan pengyin Pharmaceutical Co., Ltd  
Telephone: 13163333255
Website: www.chemicalbook.com/supplier/23345560
Company Name: Energy Chemical  
Telephone: 021-58432009 400-005-6266
Website: http://www.energy-chemical.com
Company Name: Zhuhai Anzhe Biotechnology Co,Ltd.  
Telephone: 13169972583
Website: http://www.anzhe-c.com
Tags:4499-40-5 Related Product Information
31828-71-4 21829-25-4 23031-25-6 446-86-6 50-44-2 61422-45-5 34580-14-8 6493-05-6 67-48-1 51-45-6 479-18-5 317-34-0 37148-27-9 9001-01-8 606-04-2 123-41-1 62-49-7