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Home Other Building Blocks 69922-28-7
69922-28-7,MFCD01863692
Catalog No.:AA00347Q

69922-28-7 | 5-Isocyanato-1,3-benzodioxole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$80.00   $56.00
- +
5g
98%
in stock  
$247.00   $173.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00347Q
Chemical Name:
5-Isocyanato-1,3-benzodioxole
CAS Number:
69922-28-7
Molecular Formula:
C8H5NO3
Molecular Weight:
163.1302
MDL Number:
MFCD01863692
SMILES:
O=C=Nc1ccc2c(c1)OCO2
Properties
Properties
 
Form:
Solid  
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
212  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
XLogP3:
2.4  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1989,vol.32,p.2352-2357

[1]Nalawde,YogeshMadhukar;Joshi,Vidya[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1998,vol.37,#3,p.310-313]

[2]Rigby,JamesH.;Danca,M.Diana[TetrahedronLetters,1999,vol.40,#38,p.6891-6894]

[3]Rigby,JamesH.;Laurent,Stephane;Dong,Weitong;Danca[Tetrahedron,2000,vol.56,#52,p.10101-10111]

[4]Hoshino,Yuya;Hoshino,Osamu[Heterocycles,2005,vol.66,#1,p.659-666]

69922-28-7    14763-27-0   
C14H10Cl3N3O3 

[1]Nalawde,YogeshMadhukar;Joshi,Vidya[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1998,vol.37,#3,p.310-313]

69922-28-7    84282-78-0   
C14H11ClFN3O3 

[1]Nalawde,YogeshMadhukar;Joshi,Vidya[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1998,vol.37,#3,p.310-313]

[1]Nalawde,YogeshMadhukar;Joshi,Vidya[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1998,vol.37,#3,p.310-313]

[2]MadhukarNalavde;Joshi[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2000,vol.39,#8,p.634-637]

[3]Mhatre,Vandana;Joshi,Vidya[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2002,vol.41,#12,p.2667-2675]

[4]CurrentPatentAssignee:PFIZERINC-US2005/148643,2005,A1Locationinpatent:Page/Pagecolumn19;28-29

[5]Shan,Yuanyuan;Gao,Hongping;Shao,Xiaowei;Wang,Jinfeng;Pan,Xiaoyan;Zhang,Jie[EuropeanJournalofMedicinalChemistry,2015,vol.103,p.80-90]

Literature

Title: Design and Synthesis of Imidazopyrimidine Derivatives as Potent iNOS Dimerization Inhibitors.

Journal: The open medicinal chemistry journal 20090101

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SDS
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