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8-Ethoxycaffeine
[CAS# 577-66-2]

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Identification
Name 8-Ethoxycaffeine
Synonyms 8-Ethoxy-1,3,7-Trimethyl-Purine-2,6-Dione; 8-Ethoxy-1,3,7-Trimethyl-Xanthine; St5429574
Molecular Structure CAS#: 577-66-2, 8-Ethoxycaffeine
Molecular Formula C10H14N4O3
Molecular Weight 238.25
CAS Registry Number 577-66-2
SMILES C(OC1=NC2=C([N]1C)C(N(C)C(N2C)=O)=O)C
InChI 1S/C10H14N4O3/c1-5-17-9-11-7-6(12(9)2)8(15)14(4)10(16)13(7)3/h5H2,1-4H3
InChIKey LCYXNYNRVOBSHK-UHFFFAOYSA-N
Properties
Desity 1.391g/cm3 (Cal.)
Boiling point 402.469°C at 760 mmHg (Cal.)
Flash point 197.206°C (Cal.)
Market Analysis Reports
List of Reports Available for 8-Ethoxycaffeine
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