8-Bromo-3,7-dihydro-3-methyl-7-(2-phenylethyl)-1H-purine-2,6-dione

CAS Registry Number®

101071-99-2

CAS Name

8-Bromo-3,7-dihydro-3-methyl-7-(2-phenylethyl)-1H-purine-2,6-dione

Molecular Formula

C14H13BrN4O2

Molecular Mass

349.18

Cite this Page

8-Bromo-3,7-dihydro-3-methyl-7-(2-phenylethyl)-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=101071-99-2 (retrieved 2024-10-07) (CAS RN: 101071-99-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    246-248 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C14H13BrN4O2/c1-18-11-10(12(20)17-14(18)21)19(13(15)16-11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,17,20,21)

InChIKey

InChIKey=LPIKUTPXASWEHJ-UHFFFAOYSA-N

SMILES

C(CC1=CC=CC=C1)N2C3=C(N(C)C(=O)NC3=O)N=C2Br

Canonical SMILES

O=C1NC(=O)N(C=2N=C(Br)N(C12)CCC=3C=CC=CC3)C

Other Names for this Substance

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

CAS INSIGHTSTM
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