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Home Bromides 422560-40-5
422560-40-5,MFCD00245262
Catalog No.:AA00C7GY

422560-40-5 | 2-(4-Bromo-phenyl)-N-hydroxy-acetamidine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$100.00   $70.00
- +
5g
95%
in stock  
$272.00   $190.00
- +
10g
98%
in stock  
$477.00   $334.00
- +
25g
98%
in stock  
$809.00   $567.00
- +
100g
98%
in stock  
$2,007.00   $1,405.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C7GY
Chemical Name:
2-(4-Bromo-phenyl)-N-hydroxy-acetamidine
CAS Number:
422560-40-5
Molecular Formula:
C8H9BrN2O
Molecular Weight:
229.0739
MDL Number:
MFCD00245262
SMILES:
O/N=C(\Cc1ccc(cc1)Br)/N
Properties
Properties
 
BP:
340.0±44.0 °C(Predicted)  
Form:
Solid  
MP:
132-134℃  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.7  

Downstream Synthesis Route

[1]CurrentPatentAssignee:SHIONOGI&CO.,LTD.-EP1698628,2006,A1Locationinpatent:Page/Pagecolumn28

[1]LaMotta,Concettina;Sartini,Stefania;Salerno,Silvia;Simorini,Francesca;Taliani,Sabrina;Marini,AnnaMaria;DaSettimo,Federico;Marinelli,Luciana;Limongelli,Vittorio;Novellino,Ettore[JournalofMedicinalChemistry,2008,vol.51,#11,p.3182-3193]

[2]CurrentPatentAssignee:UNIVERSITYOFVIRGINIA-WO2022/56042,2022,A1Locationinpatent:Paragraph00124;00125;00146;00147

[3]CurrentPatentAssignee:INSTITUTPASTEUR;STPHARMCO.,LTD.-US2020/31816,2020,A1Locationinpatent:Paragraph0850

[4]Moloney,GerardP.;Angus,JamesA.;Robertson,AlanD.;Stoermer,MartinJ.;Robinson,Michael;Wright,ChristineE.;McRae,Ken;Christopoulos,Arthur[EuropeanJournalofMedicinalChemistry,2008,vol.43,#3,p.513-539]

[5]CurrentPatentAssignee:SHIONOGI&CO.,LTD.-EP1698628,2006,A1Locationinpatent:Page/Pagecolumn28

[6]Paul,Saurav;Roy,Ashalata;Deka,SumanJyoti;Panda,Subhankar;Trivedi,Vishal;Manna,Debasis[EuropeanJournalofMedicinalChemistry,2016,vol.121,p.364-375]

[1]Moloney,GerardP.;Angus,JamesA.;Robertson,AlanD.;Stoermer,MartinJ.;Robinson,Michael;Wright,ChristineE.;McRae,Ken;Christopoulos,Arthur[EuropeanJournalofMedicinalChemistry,2008,vol.43,#3,p.513-539]

[1]LaMotta,Concettina;Sartini,Stefania;Salerno,Silvia;Simorini,Francesca;Taliani,Sabrina;Marini,AnnaMaria;DaSettimo,Federico;Marinelli,Luciana;Limongelli,Vittorio;Novellino,Ettore[JournalofMedicinalChemistry,2008,vol.51,#11,p.3182-3193]

5952-92-1    422560-40-5   
3-(4-bromobenzyl)-5-(1-methyl-1H-pyrazol-4-yl)-1,2,4oxadiazole 

[1]JournalofMedicinalChemistry,2015,vol.58,p.1669-1690

Literature
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SDS
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Tags:422560-40-5 Molecular Formula|422560-40-5 MDL|422560-40-5 SMILES|422560-40-5 2-(4-Bromo-phenyl)-N-hydroxy-acetamidine