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78790-88-2,MFCD11100049
Catalog No.:AA008NLE

78790-88-2 | 3-Ethoxyisonicotinic acid

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250mg
95%
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$103.00   $72.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008NLE
Chemical Name:
3-Ethoxyisonicotinic acid
CAS Number:
78790-88-2
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD11100049
SMILES:
CCOc1cnccc1C(=O)O
Properties
Computed Properties
 
Complexity:
160  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
0.7  

Upstream Synthesis Route

[1]JournalofOrganicChemistry,1981,vol.46,#21,p.4179-4182

[1]JournalofOrganicChemistry,1981,vol.46,#21,p.4179-4182

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1981,vol.46,p.4179-4182

[1]JournalofOrganicChemistry,1981,vol.46,p.4179-4182

74784-70-6    78790-88-2   
3-ethoxy-N-(5-(trifluoromethyl)pyridin-2-yl)isonicotinamide 

[1]Patent:JP2016/204325,2016,A.Locationinpatent:Paragraph0045

1448440-51-4    78790-88-2   
(S)-N-(2-(2-cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)-3-ethoxyisonicotinamide 

[1]Patent:US2019/185451,2019,A1.Locationinpatent:Paragraph0919-0922

Literature
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SDS
Tags:78790-88-2 Molecular Formula|78790-88-2 MDL|78790-88-2 SMILES|78790-88-2 3-Ethoxyisonicotinic acid