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104776-70-7,MFCD00085046
Catalog No.:AA008V1D

104776-70-7 | Ethyl 5-acetylisoxazole-3-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$145.00   $102.00
- +
5g
96%
in stock  
$411.00   $288.00
- +
10g
96%
in stock  
$710.00   $497.00
- +
25g
96%
in stock  
$1,407.00   $985.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008V1D
Chemical Name:
Ethyl 5-acetylisoxazole-3-carboxylate
CAS Number:
104776-70-7
Molecular Formula:
C8H9NO4
Molecular Weight:
183.1614
MDL Number:
MFCD00085046
SMILES:
CCOC(=O)c1noc(c1)C(=O)C
Properties
Computed Properties
 
Complexity:
216  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
XLogP3:
0.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:YUMANITYTHERAPEUTICSINC-US2019/330198,2019,A1Locationinpatent:Paragraph0712

[2]Chiarino;Grancini;Frigeni;Biasini;Carenzi[JournalofMedicinalChemistry,1991,vol.34,#2,p.600-605]

[3]DeAmici;Conti;Dallanoce;Kassi;Castellano;Stefancich;DeMicheli[MedicinalChemistryResearch,2000,vol.10,#2,p.69-80]

[4]CurrentPatentAssignee:SumitomoChemical(w/oDongwooFine-Chem);SUMITOMOCHEMICALCOMPANYLIMITED-WO2005/68432,2005,A1Locationinpatent:Page/Pagecolumn227-228

[1]Lepage;Tombret;Cuvier;Marivain;Gillardin[EuropeanJournalofMedicinalChemistry,1992,vol.27,#6,p.581-593]

[2]CurrentPatentAssignee:ORIONOYJ-WO2011/51540,2011,A1Locationinpatent:Page/Pagecolumn147

[1]Azzali,Elisa;Machado,Diana;Kaushik,Amit;Vacondio,Federica;Flisi,Sara;Cabassi,ClotildeSilvia;Lamichhane,Gyanu;Viveiros,Miguel;Costantino,Gabriele;Pieroni,Marco[JournalofMedicinalChemistry,2017,vol.60,#16,p.7108-7122]

[2]Magalhães,Joana;Franko,Nina;Raboni,Samanta;Annunziato,Giannamaria;Tammela,Päivi;Bruno,Agostino;Bettati,Stefano;Armao,Stefano;Spadini,Costanza;Cabassi,ClotildeSilvia;Mozzarelli,Andrea;Pieroni,Marco;Campanini,Barbara;Costantino,Gabriele[Pharmaceuticals,2021,vol.14,#2,p.1-16]

[3]Chiarino,D.;Fantucci,M.;Sala,A.;Veneziani,C.[JournalofHeterocyclicChemistry,1988,vol.25,p.337-342]

[4]DeAmici;Conti;Dallanoce;Kassi;Castellano;Stefancich;DeMicheli[MedicinalChemistryResearch,2000,vol.10,#2,p.69-80]

[1]Chiarino;Grancini;Frigeni;Biasini;Carenzi[JournalofMedicinalChemistry,1991,vol.34,#2,p.600-605]

[1]DeAmici;Conti;Dallanoce;Kassi;Castellano;Stefancich;DeMicheli[MedicinalChemistryResearch,2000,vol.10,#2,p.69-80]

[2]Chiarino,D.;Fantucci,M.;Sala,A.;Veneziani,C.[JournalofHeterocyclicChemistry,1988,vol.25,p.337-342]

Literature
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Tags:104776-70-7 Molecular Formula|104776-70-7 MDL|104776-70-7 SMILES|104776-70-7 Ethyl 5-acetylisoxazole-3-carboxylate