8-Bromo-3,7-dihydro-3-methyl-7-propyl-1H-purine-2,6-dione

CAS Registry Number®

101071-97-0
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CAS Name

8-Bromo-3,7-dihydro-3-methyl-7-propyl-1H-purine-2,6-dione

Molecular Formula

C9H11BrN4O2

Molecular Mass

287.11

Cite this Page

8-Bromo-3,7-dihydro-3-methyl-7-propyl-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=101071-97-0 (retrieved 2024-08-23) (CAS RN: 101071-97-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    189-190 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H11BrN4O2/c1-3-4-14-5-6(11-8(14)10)13(2)9(16)12-7(5)15/h3-4H2,1-2H3,(H,12,15,16)

InChIKey

InChIKey=VGFFHBADFGHZQK-UHFFFAOYSA-N

SMILES

C(CC)N1C2=C(N=C1Br)N(C)C(=O)NC2=O

Canonical SMILES

O=C1NC(=O)N(C=2N=C(Br)N(C12)CCC)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 8-bromo-3,7-dihydro-3-methyl-7-propyl-
  • 8-Bromo-3,7-dihydro-3-methyl-7-propyl-1H-purine-2,6-dione