7-(2,3-Dihydroxypropyl)-8-butylaminotheophylline

Modify Date: 2025-09-24 16:37:01

7-(2,3-Dihydroxypropyl)-8-butylaminotheophylline Structure
7-(2,3-Dihydroxypropyl)-8-butylaminotheophylline structure
Common Name 7-(2,3-Dihydroxypropyl)-8-butylaminotheophylline
CAS Number 111038-28-9 Molecular Weight 325.36400
Density 1.41g/cm3 Boiling Point 581.8ºC at 760mmHg
Molecular Formula C14H23N5O4 Melting Point N/A
MSDS N/A Flash Point 305.6ºC

 Names

Name 8-(butylamino)-7-(2,3-dihydroxypropyl)-1,3-dimethylpurine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.41g/cm3
Boiling Point 581.8ºC at 760mmHg
Molecular Formula C14H23N5O4
Molecular Weight 325.36400
Flash Point 305.6ºC
Exact Mass 325.17500
PSA 117.54000
Vapour Pressure 2.24E-14mmHg at 25°C
Index of Refraction 1.641
InChIKey ZENUOIDBLQHVII-UHFFFAOYSA-N
SMILES CCCCNc1nc2c(c(=O)n(C)c(=O)n2C)n1CC(O)CO

 Synonyms

7-(2,3-Dihydroxypropyl)-8-butylaminotheophylline
1H-Purine-2,6-dione,3,7-dihydro-8-(butylamino)-7-(2,3-dihydroxypropyl)-1,3-dimethyl
1H-Purine-2,6-dione,8-(butylamino)-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl
3,7-Dihydro-8-(butylamino)-7-(2,3-dihydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione
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