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115309-57-4,MFCD08277247
Catalog No.:AA000GIA

115309-57-4 | 6-Chloronicotinic acid tert-butyl ester

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Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$8.00   $6.00
- +
1g
95%
in stock  
$31.00   $22.00
- +
5g
95%
in stock  
$69.00   $49.00
- +
  • 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:
AA000GIA
Chemical Name:
6-Chloronicotinic acid tert-butyl ester
CAS Number:
115309-57-4
Molecular Formula:
C10H12ClNO2
Molecular Weight:
213.6608
MDL Number:
MFCD08277247
SMILES:
Clc1ccc(cn1)C(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
213  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
2.7  

Upstream Synthesis Route

[1]JournalofHeterocyclicChemistry,2012,vol.49,#2,p.442-445

[2]Patent:US2018/215731,2018,A1,.Locationinpatent:Paragraph0897;0909;0910;0911;0912;0913;0914

[3]Patent:WO2006/65908,2006,A1,.Locationinpatent:Page/Pagecolumn67;68

[4]OrganicProcessResearchandDevelopment,2011,vol.15,#1,p.64-72

[1]Patent:US6239152,2001,B1,

[2]OrganicProcessResearchandDevelopment,2010,vol.14,#4,p.936-938

[1]JournalofOrganicChemistry,2006,vol.71,#5,p.2000-2008

[2]Patent:US2011/301148,2011,A1,.Locationinpatent:Page/Pagecolumn12

[1]Patent:WO2006/65908,2006,A1,.Locationinpatent:Page/Pagecolumn65;66

[1]OrganicProcessResearchandDevelopment,2010,vol.14,#4,p.936-938

[2]JournalofMedicinalChemistry,2010,vol.53,#9,p.3814-3830

Downstream Synthesis Route

[1]JournalofOrganicChemistry,2006,vol.71,p.2000-2008

[2]Patent:US2011/301148,2011,A1.Locationinpatent:Page/Pagecolumn12

[1]JournalofHeterocyclicChemistry,2012,vol.49,p.442-445

[2]Patent:US2018/215731,2018,A1.Locationinpatent:Paragraph0897;0909;0910;0911;0912;0913;0914

[3]Patent:WO2006/65908,2006,A1.Locationinpatent:Page/Pagecolumn67;68

[4]Organicprocessresearchanddevelopment,2011,vol.15,p.64-72

[5]Patent:CN110183442,2019,A.Locationinpatent:Paragraph0007

[1]JournalofMedicinalChemistry,2010,vol.53,p.3814-3830

[2]OrganicProcessResearchandDevelopment,2010,vol.14,p.936-938

[3]Patent:WO2006/65908,2006,A1.Locationinpatent:Page/Pagecolumn66;67

[4]Organicprocessresearchanddevelopment,2011,vol.15,p.64-72

115309-57-4   
4-(5S,9R)-3-(3,5-dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro4.4non-9-yl-benzonitrilesemi-(+)-di-p-toluoyl-D-tartaricacidsalt 
  893397-49-4 

[1]Patent:WO2006/65908,2006,A1.Locationinpatent:Page/Pagecolumn67;68

115309-57-4   
tert-butyl6-(2-aminoethyl)aminopyridine-3-carboxylate 

[1]Patent:US2002/156087,2002,A1

[2]Patent:US6417185,2002,B1

Literature
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Tags:115309-57-4 Molecular Formula|115309-57-4 MDL|115309-57-4 SMILES|115309-57-4 6-Chloronicotinic acid tert-butyl ester