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52700-65-9,MFCD00466777
Catalog No.:AA00DD6P

52700-65-9 | N-(2-Bromophenyl)-3-oxobutanamide

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA00DD6P
Chemical Name:
N-(2-Bromophenyl)-3-oxobutanamide
CAS Number:
52700-65-9
Molecular Formula:
C10H10BrNO2
Molecular Weight:
256.0959
MDL Number:
MFCD00466777
SMILES:
O=C(Nc1ccccc1Br)CC(=O)C
Properties
Computed Properties
 
Complexity:
230  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.8  

Downstream Synthesis Route
52700-65-9   
8-bromo-4-methyl-quinolin-2-ol 

[1]Tikotikaretal.[JournaloftheKarnatakUniversity,1956,vol.1,p.43,45]

[1]CurrentPatentAssignee:PFIZERINC-WO2008/121687,2008,A2Locationinpatent:Page/Pagecolumn46

[2]Tikotikaretal.[JournaloftheKarnatakUniversity,1956,vol.1,p.43,45]

[3]Sivaramakarthikeyan,Ramar;Iniyaval,Shunmugam;Padmavathy,Krishnaraj;Liew,Hui-Shan;Looi,Chin-King;Mai,Chun-Wai;Ramalingan,Chennan[NewJournalofChemistry,2019,vol.43,#43,p.17046-17057]

[4]Iniyaval,Shunmugam;Karuppasamy,Ayyanar;Lim,Wei-Meng;Mai,Chun-Wai;Padmavathy,Krishnaraj;Ramalingan,Chennan;Sivaramakarthikeyan,Ramar[NewJournalofChemistry,2020,vol.44,#10,p.4049-4060]

[1]Bagrov,F.V.[JournalofgeneralchemistryoftheUSSR,1991,vol.61,#4.1,p.804-807][ZhurnalObshcheiKhimii,1991,vol.61,#4,p.886-889]

[1]Habashi,Adiba;Ibraheim,NadiaSobhy;Sherif,SherifMourad;Shams,HodaZaki;Mohareb,RafatdMilad[Heterocycles,1986,vol.24,#9,p.2463-2466]

140-87-4    52700-65-9   
<i>N</i>-(2-bromo-phenyl)-3-(cyanoacetyl-hydrazono)-butyramide 

[1]Bagrov[RussianJournalofGeneralChemistry,1999,vol.69,#9,p.1427-1429]

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SDS
Tags:52700-65-9 Molecular Formula|52700-65-9 MDL|52700-65-9 SMILES|52700-65-9 N-(2-Bromophenyl)-3-oxobutanamide