3,7-Dihydro-7-(3-hydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione

CAS Registry Number®

23146-04-5

CAS Name

3,7-Dihydro-7-(3-hydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione

Molecular Formula

C10H14N4O3

Molecular Mass

238.24

Cite this Page

3,7-Dihydro-7-(3-hydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23146-04-5 (retrieved 2024-09-28) (CAS RN: 23146-04-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    151-152 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H14N4O3/c1-12-8-7(9(16)13(2)10(12)17)14(6-11-8)4-3-5-15/h6,15H,3-5H2,1-2H3

InChIKey

InChIKey=QCGRMMZPZDAITA-UHFFFAOYSA-N

SMILES

C(CCO)N1C2=C(N(C)C(=O)N(C)C2=O)N=C1

Canonical SMILES

O=C1C2=C(N=CN2CCCO)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(3-hydroxypropyl)-1,3-dimethyl-
  • Theophylline, 7-(3-hydroxypropyl)-
  • 3,7-Dihydro-7-(3-hydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione
  • 7-(γ-Hydroxypropyl)theophylline
  • X 991

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