8-Ethoxy-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione

CAS Registry Number®

577-66-2
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CAS Name

8-Ethoxy-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione

Molecular Formula

C10H14N4O3

Molecular Mass

238.24

Cite this Page

8-Ethoxy-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=577-66-2 (retrieved 2024-05-04) (CAS RN: 577-66-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    137 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey=LCYXNYNRVOBSHK-UHFFFAOYSA-N

SMILES

CN1C2=C(N(C)C(OCC)=N2)C(=O)N(C)C1=O

Canonical SMILES

O=C1C2=C(N=C(OCC)N2C)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 8-ethoxy-3,7-dihydro-1,3,7-trimethyl-
  • Caffeine, 8-ethoxy-
  • 8-Ethoxy-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
  • EOC
  • 8-Ethoxycaffeine

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