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THEOBROMINE

  • CAS No:83-67-0 3,7-dimethylpurine-2,6-dione
    Molecular Structure

    Other Information

  • CAS Registry Number: 83-67-0
  • Transport: OTH
  • Melting Point: 290-295 ºC
  • Boiling Point: Sublimes 290-295 deg C
  • Density: 1.50
  • Refractive index: 1.737
  • Safety Statements: R22
  • Hazard Symbols: Xn: Harmful;
  • EINECS: 201-494-2
  • Molecular Weight: 180.16402
  • InchiKey: YAPQBXQYLJRXSA-UHFFFAOYSA-N
  • InChI: InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,
    13)
  • Risk Statements: S22;S24/25
  • Molecular Formula: C7H8N4O2