7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1)

CAS Registry Number®

35206-03-2

CAS Name

7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1)

Molecular Formula

C14H24N5O2.I

Cite this Page

7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35206-03-2 (retrieved 2025-01-03) (CAS RN: 35206-03-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    234 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H24N5O2.HI/c1-6-19(5,7-2)9-8-18-10-15-12-11(18)13(20)17(4)14(21)16(12)3;/h10H,6-9H2,1-5H3;1H/q+1;/p-1

InChIKey

InChIKey=ZRNCURVARUWAMN-UHFFFAOYSA-M

SMILES

C(C[N+](CC)(CC)C)N1C2=C(N=C1)N(C)C(=O)N(C)C2=O.[I-]

Canonical SMILES

[I-].O=C1C2=C(N=CN2CC[N+](C)(CC)CC)N(C(=O)N1C)C

Other Names for this Substance

  • 7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide (1:1)
  • 7H-Purine-7-ethanaminium, N,N-diethyl-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-, iodide
  • Etamiphyllin methiodide
  • Simesphylline

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