CAS Number69975-86-6
SynonymsMaxivent; Doxofilina [INN-Spanish]; Doxofylline; Ansimar; 7-(1,3-Dioxolan-2-ylmethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione; Ventax; Doxofyllinum [INN-Latin]; 7-(1,3-dioxolan-2-ylmethyl)theophylline; doxophylline; EINECS 274-239-6; Dioxyfilline; 2-(7'-theophyllinemethyl)-1,3-dioxolane; 7-(1,3-Dioxolan-2-ylmethyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione; 7-(1,3-dioxolan-2-yl-methyl)3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione; MFCD00865218
Molecular FormulaC11H14O4N4
Molecular Weight266.26
Purity99%
Density1.6±0.1 g/cm3
Boiling Point505.2±53.0 °C at 760 mmHg
Melting Point144-146ºC
AppearanceSolid;White to Almost white powder to crystal
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 69975-86-6 |
| Catalog No. | 2A-9010245 |
| Chinese Name | 多索茶碱 |
| Synonyms | Maxivent; Doxofilina [INN-Spanish]; Doxofylline; Ansimar; 7-(1,3-Dioxolan-2-ylmethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione; Ventax; Doxofyllinum [INN-Latin]; 7-(1,3-dioxolan-2-ylmethyl)theophylline; doxophylline; EINECS 274-239-6; Dioxyfilline; 2-(7'-theophyllinemethyl)-1,3-dioxolane; 7-(1,3-Dioxolan-2-ylmethyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione; 7-(1,3-dioxolan-2-yl-methyl)3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione; MFCD00865218 |
| Molecular Formula | C11H14O4N4 |
| Molecular Weight | 266.26 |
| Purity | 99 |
| Density | 1.6±0.1 g/cm3 |
| Boiling Point | 505.2±53.0 °C at 760 mmHg |
| Melting Point | 144-146ºC |
| Appearance | Solid;White to Almost white powder to crystal |
| Water Solubility | Soluble |
| Storage Condition | Room Temperature |
| Application | Doxofylline is an antagonist of the adenosine A1 receptor and inhibits phosphodiesterase IV. |
| MDL Number | MFCD00865218 |
| SMILES | Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O |
| InChI | InChI=1S/C11H14N4O4/c1-13-9-8(10(16)14(2)11(13)17)15(6-12-9)5-7-18-3-4-19-7/h6-7H,3-5H2,1-2H3 |
| InChI Key | HWXIGFIVGWUZAO-UHFFFAOYSA-N |
| MSDS | msds/10245_1_69975_86_6.pdf |
| Bioactivity | Doxofylline is an antagonist of adenosine A1 receptor which also inhibits phosphodiesterase IV. Related Catalog Signaling Pathways >> GPCR/G Protein >> Adenosine Receptor Signaling Pathways >> Metabolic Enzyme/Protease >> Phosphodiesterase (PDE) Research Areas >> Inflammation/Immunology Target Adenosine A1 receptor, phosphodiesterase IV[1] References [1]. Shukla D, et al. Doxofylline: a promising methylxanthine derivative for the treatment of asthma and chronic obstructive pulmonary disease. Expert Opin Pharmacother. 2009 Oct;10(14):2343-56. Chemical & Physical Properties Density 1.6±0.1 g/cm3 Boiling Point 505.2±53.0 °C at 760 mmHg Melting Point 144-146ºC Molecular Formula C11H14N4O4 Molecular Weight 266.253 Flash Point 259.3±30.9 °C Exact Mass 266.101501 PSA 80.28000 LogP -0.70 Vapour Pressure 0.0±1.3 mmHg at 25°C Index of Refraction 1.700 InChIKey HWXIGFIVGWUZAO-UHFFFAOYSA-N SMILES Cn1c(=O)c2c(ncn2CC2OCCO2)n(C)c1=O Water Solubility Soluble |
| Use of | Doxofylline is an antagonist of adenosine A1 receptor which also inhibits phosphodiesterase IV. Properties Name 7-(1,3-dioxolan-2-ylmethyl)-1,3-dimethylpurine-2,6-dione Synonym More Synonyms Doxofylline Biological Activity Description Doxofylline is an antagonist of adenosine A1 receptor which also inhibits phosphodiesterase IV. Related Catalog Signaling Pathways >> GPCR/G Protein >> Adenosine Receptor Signaling Pathways >> Metabolic Enzyme/Protease >> Phosphodiesterase (PDE) Research Areas >> Inflammation/Immunology Adenosine A1 receptor, phosphodiesterase IV[1] References [1]. Shukla D, et al. Doxofylline: a promising methylxanthine derivative for the treatment of asthma and chronic obstructive pulmonary disease. Expert Opin Pharmacother. 2009 Oct;10(14):2343-56. Chemical & Physical Properties Molecular Formula C11H14N4O4 Exact Mass 266.101501 PSA 80.28000 LogP -0.70 Index of Refraction 1.700 InChIKey HWXIGFIVGWUZAO-UHFFFAOYSA-N Water Solubility Soluble |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: inconsistent with United Nations classification standards UN number: not specified Doxophylline Modification Number: 5 |
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