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CS-W001157 4
Total: USD 88.00

1,9-Dimethylxanthine

  • CAS No. 33073-01-7

  • Cat. No. CS-0556608
  • Purity≥98%
  • MDL No.MFCD00042775

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

1,9-Dimethylxanthine|CS-0556608

Structure of 33073-01-7

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General Information

  • CAS No. 33073-01-7
  • Cat. No. CS-0556608
  • Purity ≥98%
  • MDL No. MFCD00042775
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₄O₂
  • Molecular Weight 180.16
  • Synonym(s) None
  • SMILES O=C1NC2=C(C(N1C)=O)N=CN2C

Synthesis

  • Route1
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      13922-79-7
    • ~%
    • 1,9-Dimethylxanthine|CS-0556608
      33073-01-7

    References

    • Biltz et al. Justus Liebigs Annalen der Chemie, 1921 , vol. 423, p. 215 Justus Liebigs Annalen der Chemie, 1922 , vol. 426, p. 242 Full Text Show Details Biltz; Pardon Justus Liebigs Annalen der Chemie, 1935 , vol. 515, p. 201,250

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   72.68
  • LogP   -1.0397
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   0

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