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

CAS Registry Number®

1236-36-8

CAS Name

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

Molecular Formula

C16H19N5O2.ClH

Cite this Page

1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[2-[(phenylmethyl)amino]ethyl]-, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1236-36-8 (retrieved 2024-11-24) (CAS RN: 1236-36-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    260-265 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H19N5O2.ClH/c1-19-14-13(15(22)20(2)16(19)23)21(11-18-14)9-8-17-10-12-6-4-3-5-7-12;/h3-7,11,17H,8-10H2,1-2H3;1H

InChIKey

InChIKey=ZDYNLEXCQDOPCC-UHFFFAOYSA-N

SMILES

C(CNCC1=CC=CC=C1)N2C3=C(N(C)C(=O)N(C)C3=O)N=C2.Cl

Canonical SMILES

Cl.O=C1C2=C(N=CN2CCNCC=3C=CC=CC3)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[2-[(phenylmethyl)amino]ethyl]-, hydrochloride (1:1)
  • Theophylline, 7-[2-(benzylamino)ethyl]-, monohydrochloride
  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[2-[(phenylmethyl)amino]ethyl]-, monohydrochloride

CAS INSIGHTSTM
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