Chemical Properties of Theophylline, 7-(2,3-dihydroxypropyl)- (CAS 479-18-5)

Theophylline, 7-(2,3-dihydroxypropyl)-

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InChI
InChI=1S/C10H14N4O4/c1-12-8-7(9(17)13(2)10(12)18)14(5-11-8)3-6(16)4-15/h5-6,15-16H,3-4H2,1-2H3
InChI Key
KSCFJBIXMNOVSH-UHFFFAOYSA-N
Formula
C10H14N4O4
SMILES
Cn1c2ncn(CC(O)CO)c2c(=O)n(C)c1=O
Molecular Weight1
254.24
CAS
479-18-5
Other Names
  • (1,2-Dihydroxy-3-propyl)thiophyllin
  • 1,3-Dimethyl-7-(2,3-dihydroxypropyl)xanthine
  • 1H-Purine-2,6-dione, 7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-
  • 7-(2,3-Dihydroxypropyl)-1,3-dimethylxanthine
  • 7-(2,3-Dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
  • 7-(2,3-Dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (dyphylline)
  • 7-(2,3-Dihydroxypropyl)theophylline
  • 7-(2,3-Dioxypropyl)theophylline
  • 7-(«beta»,«gamma»-Dihydroxypropyl)theophylline
  • AFI-Phyllin
  • Aristophyllin
  • Asthmolysin
  • Astmamasit
  • Astrophyllin
  • Circain
  • Circair
  • Cor-Theophylline
  • Coronal
  • Coronarin
  • Corphyllin
  • Dihydroxypropyl theophylline
  • Dihydroxypropyl theopylin
  • Dilor
  • Diphyllin
  • Diphylline
  • Diprofillin
  • Diprofilline
  • Diprophyllin
  • Diprophylline
  • Dipropylline
  • Droxine
  • Dyflex
  • Glyfyllin
  • Glyphyllin
  • Glyphylline
  • Hidroxiteofillina
  • Hiphyllin
  • Hyphylline
  • Iphyllin
  • Isophyllen
  • Liactemin
  • Lufyllin
  • Neo-Vasophylline
  • Neophyl
  • Neophyllin
  • Neophylline
  • Neostenovasan
  • Neothyllin
  • Neothylline
  • Neotilina
  • Neufil
  • Neutrafil
  • Neutrafillina
  • Neutraphyllin
  • Neutraphylline
  • Neutroxantina
  • Propyphyllin
  • Protheophylline
  • Purifilin
  • Silbephyllin
  • Silbephylline
  • Solufilin
  • Solufyllin
  • Soluphyllin
  • Synthophylline
  • Tefilan
  • Teofen
  • Theal
  • Theal ampules
  • Thefylan
  • Theophylline, 7-(2,3-dihydroxypropyl)-
Sources

Physical Properties

Property Value Unit Source
logPoct/wat -2.21 Crippen Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 39.30 kJ/mol 435.7 NIST

Similar Compounds

Proxyphylline. Etofylline. 1H-purine-2,6-dione, 7-ethyl-3,7-dihydro-1,3-dimethyl-. Etamiphyllin. Pentifylline. Paraxanthine, n-propyl derivative. 1-(6'-hydroxyhexyl)-3-methyl-7-propylxanthine, O-TFA. Caffeine. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl. FENETHYLLINE. Xanthine, 7-(5'-oxohexyl)-3-methyl-1-propyl. 1-(5'-hydroxyhexyl)-3,7-dimethylxanthine, O-TFA. 1,3,7-Trimethyluric acid. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TMS. Tetramethyluric acid.

Find more compounds similar to Theophylline, 7-(2,3-dihydroxypropyl)-.

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