1H-Purine-2,6-dione, 7-[2-(diethylamino)ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1)

CAS Registry Number®

17140-68-0
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CAS Name

1H-Purine-2,6-dione, 7-[2-(diethylamino)ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1)

Molecular Formula

C13H21N5O2.ClH

Cite this Page

1H-Purine-2,6-dione, 7-[2-(diethylamino)ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17140-68-0 (retrieved 2024-05-18) (CAS RN: 17140-68-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    239-241 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C13H21N5O2.ClH/c1-5-17(6-2)7-8-18-9-14-11-10(18)12(19)16(4)13(20)15(11)3;/h9H,5-8H2,1-4H3;1H

InChIKey

InChIKey=WZNIVRAEOQQUIB-UHFFFAOYSA-N

SMILES

C(CN(CC)CC)N1C2=C(N(C)C(=O)N(C)C2=O)N=C1.Cl

Canonical SMILES

Cl.O=C1C2=C(N=CN2CCN(CC)CC)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 7-[2-(diethylamino)ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1)
  • Theophylline, 7-[2-(diethylamino)ethyl]-, monohydrochloride
  • 1H-Purine-2,6-dione, 7-[2-(diethylamino)ethyl]-3,7-dihydro-1,3-dimethyl-, monohydrochloride
  • Theophylline, 7-(2-diethylaminoethyl)-, hydrochloride
  • 7-(Diethylaminoethyl)theophylline hydrochloride

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Deleted or Replaced CAS Registry Numbers

60508-93-2

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