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8-(2-Hydroxyethylamino)Theophyline
[CAS# 7654-01-5]

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Identification
Name 8-(2-Hydroxyethylamino)Theophyline
Synonyms 8-(2-Hydroxyethylamino)-1,3-Dimethyl-7H-Purine-2,6-Quinone; Zinc03118440; 8-(2-Hydroxyethyl)Aminotheophylline
Molecular Structure CAS#: 7654-01-5, 8-(2-Hydroxyethylamino)Theophyline
Molecular Formula C9H13N5O3
Molecular Weight 239.23
CAS Registry Number 7654-01-5
SMILES C(NC2=NC1=C(C(N(C)C(N1C)=O)=O)[NH]2)CO
InChI 1S/C9H13N5O3/c1-13-6-5(7(16)14(2)9(13)17)11-8(12-6)10-3-4-15/h15H,3-4H2,1-2H3,(H2,10,11,12)
InChIKey MPFKMHMADVNVJA-UHFFFAOYSA-N
Properties
Density 1.5±0.1g/cm3 (Cal.)
Boiling point 516.2±60.0°C at 760 mmHg (Cal.)
Flash point 266.0±32.9°C (Cal.)
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