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90721-27-0,MFCD01006742
Catalog No.:AA003DW8

90721-27-0 | 1-Benzofuran-5-carboxylic acid

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Purity
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Price(USD)
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250mg
97%
in stock  
$14.00   $10.00
- +
1g
97%
in stock  
$24.00   $17.00
- +
5g
95%
in stock  
$102.00   $72.00
- +
10g
95%
in stock  
$191.00   $134.00
- +
25g
95%
in stock  
$418.00   $293.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003DW8
Chemical Name:
1-Benzofuran-5-carboxylic acid
CAS Number:
90721-27-0
Molecular Formula:
C9H6O3
Molecular Weight:
162.1421
MDL Number:
MFCD01006742
SMILES:
OC(=O)c1ccc2c(c1)cco2
Properties
Properties
 
BP:
325.6 °C at 760 mmHg  
Form:
Solid  
MP:
189-190 °C  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
190  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Upstream Synthesis Route

[1]Patent:US2003/232853,2003,A1,.Locationinpatent:Page37

[2]Patent:WO2004/39815,2004,A2,.Locationinpatent:Page70

[3]Patent:WO2017/155909,2017,A1,.Locationinpatent:Paragraph0182

[4]BioorganicandMedicinalChemistry,2018,vol.26,#8,p.1797-1809

[5]JournalofMedicinalChemistry,1995,vol.38,#16,p.3094-3105

[6]Patent:WO2016/100184,2016,A1,.Locationinpatent:Paragraph00341-00342

[7]JournalofMedicinalChemistry,2006,vol.49,#14,p.4425-4436

[1]Patent:US2003/232853,2003,A1,.Locationinpatent:Page39

[1]Patent:US2003/105089,2003,A1,

[1]JournalofMedicinalChemistry,2006,vol.49,#14,p.4425-4436

[1]JournalofMedicinalChemistry,2006,vol.49,#14,p.4425-4436

Downstream Synthesis Route
90721-27-0    3886-69-9   
(-)-5-benzofuranoyl-α-methylbenzylamine 

[1]BioorganicChemistry,1993,vol.21,p.415-422

[1]JournalofMedicinalChemistry,1995,vol.38,p.3094-3105

[2]Heterocycles,1998,vol.48,p.2669-2675

[3]ChemMedChem,2016,p.1122-1128

[4]Patent:WO2016/100184,2016,A1.Locationinpatent:Paragraph00905-00906

[5]JournaloftheAmericanChemicalSociety,2016,vol.138,p.15315-15318

[1]Patent:US2003/232853,2003,A1.Locationinpatent:Page37

[2]Patent:WO2004/39815,2004,A2.Locationinpatent:Page70

[3]Patent:WO2017/155909,2017,A1.Locationinpatent:Paragraph0182

[4]BioorganicandMedicinalChemistry,2018,vol.26,p.1797-1809

[5]JournalofMedicinalChemistry,1995,vol.38,p.3094-3105

[6]Patent:WO2016/100184,2016,A1.Locationinpatent:Paragraph00341-00342

[7]JournalofMedicinalChemistry,2006,vol.49,p.4425-4436

90721-27-0    98946-18-0   
tert-butyl1-benzofuran-5-carboxylate 

[1]SyntheticCommunications,2006,vol.36,p.3117-3123

90721-27-0    6530-09-2   
N-(3R)-1-azabicyclo2.2.2oct-3-yl-1-benzofuran-5-carboxamide 

[1]JournalofMedicinalChemistry,2006,vol.49,p.4425-4436

Literature
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SDS
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