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CS-W001157 4
Total: USD 88.00

2-(Chloromethyl)benzofuro[3,2-d]pyrimidin-4(3H)-one

  • CAS No. 80550-76-1

  • Cat. No. CS-0234000
  • Purity≥97%
  • MDL No.None

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

2-(Chloromethyl)benzofuro[3,2-d]pyrimidin-4(3H)-one|CS-0234000

Structure of 80550-76-1

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General Information

  • CAS No. 80550-76-1
  • Cat. No. CS-0234000
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇ClN₂O₂
  • Molecular Weight 234.64
  • Synonym(s) 4-(Chloromethyl)-8-oxa-3,5-diazatricyclo[7.4.0.0,2,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
  • SMILES O=C1NC(CCl)=NC2=C1OC3=CC=CC=C23

Synthesis

  • Route1
    • null|null
      80551-19-5
    • ~93%
    • 2-(Chloromethyl)benzofuro[3,2-d]pyrimidin-4(3H)-one|CS-0234000
      80550-76-1

    References

    • Vaidya, V. P.; Agasimundin, Y. S. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1981 , vol. 20, # 9 p. 780 - 783
  • Route2

    References

    • Vaidya, V. P.; Agasimundin, Y. S. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1981 , vol. 20, # 9 p. 780 - 783

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   58.89
  • LogP   2.4081
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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