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CS-W001157 4
Total: USD 88.00

7-Bromoquinazoline-2,4(1H,3H)-dione

  • CAS No. 114703-12-7

  • Cat. No. CS-D0576
  • Purity≥98%
  • MDL No.MFCD09954848

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

7-Bromoquinazoline-2,4(1H,3H)-dione|CS-D0576

Structure of 114703-12-7

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General Information

  • CAS No. 114703-12-7
  • Cat. No. CS-D0576
  • Purity ≥98%
  • MDL No. MFCD09954848
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrN₂O₂
  • Molecular Weight 241.04
  • Synonym(s) 7-bromoquinazoline-2,4-diol
  • SMILES OC1=NC2=CC(Br)=CC=C2C(O)=N1

Synthesis

  • Route1
    • In-stock
      Methyl 2-amino-4-bromobenzoate|CS-W004770
      135484-83-2
    • null|null
      917-61-3
    • ~72%
    • In-stock
      7-Bromoquinazoline-2,4(1H,3H)-dione|CS-D0576
      114703-12-7

    References

    • MERCK PATENT GMBH; Mederski, Werner; Fuchss, Thomas; Zenke, Frank Patent: US2013/12489 A1, 2013 ; Location in patent: Paragraph 0173 ;
  • Route2

    References

    • ENDO PHARMACEUTICALS INC.; SMITH, Roger, Astbury; THOMPSON, Scott, Kevin; HOSAHALLI, Subramanya; BEJUGAM, Mallesham; NANDURI, Srinivas; PANIGRAHI, Sunil, Kumar; MAHALINGAM, Natarajan Patent: WO2012/58671 A1, 2012 ; Location in patent: Page/Page column 92 ;
  • Route3

    References

    • Endo Pharmaceuticals Inc.; Smith, Roger Astbury; Venkatesan, Aranapakam; Bejugam, Mallesham; Hoshalli, Subramanya; Nanduri, Srinivas Patent: US2014/38952 A1, 2014 ; Location in patent: Page/Page column 0158-0159 ;

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.24
  • LogP   1.8035
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   0

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