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CS-W001157 4
Total: USD 88.00

1-Benzyl-pyrimidine-2,4,6-trione

  • CAS No. 91360-95-1

  • Cat. No. CS-0070400
  • Purity≥97%
  • MDL No.MFCD00104232

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

1-Benzyl-pyrimidine-2,4,6-trione|CS-0070400

Structure of 91360-95-1

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General Information

  • CAS No. 91360-95-1
  • Cat. No. CS-0070400
  • Purity ≥97%
  • MDL No. MFCD00104232
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀N₂O₃
  • Molecular Weight 218.21
  • Synonym(s) 1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione
  • SMILES O=C(NC(C1)=O)N(CC2=CC=CC=C2)C1=O

Synthesis

  • Route1

    References

    • Jurok, Radek; Cibulka, Radek; Dvorakova, Hana; Hampl, Frantisek; Hodacova, Jana European Journal of Organic Chemistry, 2010 , # 27 p. 5217 - 5224
  • Route2

    References

    • US2003/78276 A1, ; US 20030078276 A1
  • Route3
    • null|null
      147917-37-1
    • ~84%
    • 1-Benzyl-pyrimidine-2,4,6-trione|CS-0070400
      91360-95-1

    References

    • Krasnov, K. A.; Slesarev, V. I.; Selimanova, I. N. Journal of Organic Chemistry USSR (English Translation), 1992 , vol. 28, # 7 p. 1215 - 1220 Zhurnal Organicheskoi Khimii, 1992 , vol. 28, # 7 p. 1531 - 1537

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   66.48
  • LogP   0.6551
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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