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CS-W001157 4
Total: USD 88.00

7-Methylxanthine

  • CAS No. 552-62-5

  • Cat. No. CS-W017879
  • Purity≥98%
  • MDL No.MFCD00037979

*For research and further manufacturing use only, not for direct human use.

7-Methylxanthine|CS-W017879

Structure of 552-62-5

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General Information

  • CAS No. 552-62-5
  • Cat. No. CS-W017879
  • Purity ≥98%
  • MDL No. MFCD00037979
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆N₄O₂
  • Molecular Weight 166.14
  • Synonym(s) None
  • SMILES CN1C=NC2=C1C(=O)NC(=O)N2

Description

SupraSolv solvents for headspace gas chromatography are developed particularly for the analysis of residualsolvents in drug substances, excipients and drug products according to ICH, Ph Eur and USP - SupraSolv headspace solvents are tested for allresidual solvents defined by the ICH.

Synthesis

  • Route1
    • null|null
      64995-73-9
    • ~74%
    • In-stock
      7-Methylxanthine|CS-W017879
      552-62-5

    References

    • Mueller, Christa E.; Thorand, Mark; Qurishi, Ramatullah; Diekmann, Martina; Jacobson, Kenneth A.; Padgett, William L.; Daly, John W. Journal of Medicinal Chemistry, 2002 , vol. 45, # 16 p. 3440 - 3450
  • Route2
    • null|null
      1021187-27-8
    • ~92%
    • In-stock
      7-Methylxanthine|CS-W017879
      552-62-5

    References

    • Kowalska, Alicja; Pluta, Krystian Heterocycles, 2008 , vol. 75, # 3 p. 555 - 569
  • Route3
    • null|null
      1021187-29-0
    • ~92%
    • In-stock
      7-Methylxanthine|CS-W017879
      552-62-5

    References

    • Kowalska, Alicja; Pluta, Krystian Heterocycles, 2008 , vol. 75, # 3 p. 555 - 569

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   83.54
  • LogP   -1.0501
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   0

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