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17874-78-1,MFCD09607895
Catalog No.:AA00266X

17874-78-1 | 6-(Ethoxycarbonyl)nicotinic acid

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Purity
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100mg
95%
1 week  
$48.00   $34.00
- +
250mg
95%
1 week  
$81.00   $57.00
- +
1g
95%
1 week  
$215.00   $151.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00266X
Chemical Name:
6-(Ethoxycarbonyl)nicotinic acid
CAS Number:
17874-78-1
Molecular Formula:
C9H8NO4-
Molecular Weight:
194.1641
MDL Number:
MFCD09607895
SMILES:
CCOC(=O)c1ccc(cn1)C(=O)[O-]
Properties
Computed Properties
 
Complexity:
229  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
0.9  

Downstream Synthesis Route

[1]Finch;Campbell;Gemenden;Povalski[JournalofMedicinalChemistry,1980,vol.23,#12,p.1405-1410]

[1]Schlecker,Wolfgang;Huth,Andreas;Otow,Eckhard[JournalofOrganicChemistry,1995,vol.60,#26,p.8414-8416]

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2008/11131,2008,A2Locationinpatent:Page/Pagecolumn255

[2]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2008/11131,2008,A2Locationinpatent:Page/Pagecolumn255

[3]Bernard,Harald;Buelow,Gerd;Lange,UdoE.W.;Mack,Helmut;Pfeiffer,Thomas;Schaefer,Bernd;Seitz,Werner;Zierke,Thomas[Synthesis,2004,#14,p.2367-2375]

[1]Bernard,Harald;Buelow,Gerd;Lange,UdoE.W.;Mack,Helmut;Pfeiffer,Thomas;Schaefer,Bernd;Seitz,Werner;Zierke,Thomas[Synthesis,2004,#14,p.2367-2375]

Literature
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SDS
Tags:17874-78-1 Molecular Formula|17874-78-1 MDL|17874-78-1 SMILES|17874-78-1 6-(Ethoxycarbonyl)nicotinic acid