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66171-50-4,MFCD08436011
Catalog No.:AA003RVS

66171-50-4 | Methyl 6-oxo-1,6-dihydro-3-pyridinecarboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$7.00   $5.00
- +
5g
97%
in stock  
$17.00   $12.00
- +
10g
97%
in stock  
$22.00   $15.00
- +
25g
97%
in stock  
$50.00   $35.00
- +
100g
97%
in stock  
$195.00   $137.00
- +
  • 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:
AA003RVS
Chemical Name:
Methyl 6-oxo-1,6-dihydro-3-pyridinecarboxylate
CAS Number:
66171-50-4
Molecular Formula:
C7H7NO3
Molecular Weight:
153.1354
MDL Number:
MFCD08436011
SMILES:
COC(=O)c1ccc(nc1)O
Properties
Properties
 
BP:
342.4°C at 760 mmHg  
Form:
Solid  
MP:
166-170 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
252  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
-0.2  

Upstream Synthesis Route

[1]JournalofMedicinalChemistry,2014,vol.57,#15,p.6679-6703

[2]Patent:WO2012/52444,2012,A1,.Locationinpatent:Page/Pagecolumn12

[3]Chemistry-AEuropeanJournal,2009,vol.15,#24,p.5950-5955

[4]Patent:WO2009/106885,2009,A1,.Locationinpatent:Page/Pagecolumn296

[5]OrganicandBiomolecularChemistry,2010,vol.8,#15,p.3534-3542

[6]Patent:US2012/101282,2012,A1,.Locationinpatent:Page/Pagecolumn6

[7]JournalofMedicinalChemistry,2001,vol.44,#19,p.3141-3149

[8]Patent:EP1647546,2006,A1,.Locationinpatent:Page/Pagecolumn52

[9]Bl.TextileRes.Inst.Yokohama,1956,#38,p.82,85

[10]Chem.Abstr.,1961,p.14455

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

[12]BioorganicandMedicinalChemistry,2013,vol.21,#10,p.2687-2694

[13]OrganicProcessResearchandDevelopment,2013,vol.17,#6,p.940-945

[1]JournalofOrganometallicChemistry,2017,vol.843,p.14-19

[1]Patent:US2001/19823,2001,A1,

[1]MonatsheftefuerChemie,1901,vol.22,p.437

[2]Patent:US5512581,1996,A,

[3]Patent:US5521173,1996,A,

[1]Synthesis,1995,#3,p.285-293

[2]Patent:US6534545,2003,B1,

[3]JournalofOrganicChemistry,1996,vol.61,#25,p.8940-8948

[4]Patent:WO2007/44491,2007,A1,.Locationinpatent:Page/Pagecolumn31;35

Downstream Synthesis Route
110-52-1    66171-50-4   
1,4-bis-(5-methoxycarbonyl-2-oxo-2<i>H</i>-1pyridyl)-butane 

[1],1956,vol.38,p.82,85    Chem.Abstr.,1961,p.14455

66171-50-4    106-93-4   
6,6'-dioxo-1,6,1',6'-tetrahydro-1,1'-ethanediyl-bis-pyridine-3-carboxylicaciddimethylester 

[1],1956,vol.38,p.82,85    Chem.Abstr.,1961,p.14455

66171-50-4    107-07-3   
1-(2-hydroxy-ethyl)-6-oxo-1,6-dihydro-pyridine-3-carboxylicacidmethylester 

[1],1956,vol.38,p.82,85    Chem.Abstr.,1961,p.14455

[1]JournalofOrganicChemistry,1980,vol.45,p.4508-4511

[1]Patent:WO2012/52444,2012,A1.Locationinpatent:Page/Pagecolumn12-13

[2]Patent:US2012/101282,2012,A1.Locationinpatent:Page/Pagecolumn6

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

[4]OrganicProcessResearchandDevelopment,2013,vol.17,p.940-945

Literature
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SDS
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