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105404-33-9,MFCD20257640
Catalog No.:AA0095OY

105404-33-9 | Methyl 2-oxo-1,2,3,4-tetrahydroquinoline-3-carboxylate

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100mg
95%
in stock  
$215.00   $150.00
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250mg
95%
in stock  
$428.00   $299.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0095OY
Chemical Name:
Methyl 2-oxo-1,2,3,4-tetrahydroquinoline-3-carboxylate
CAS Number:
105404-33-9
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD20257640
SMILES:
COC(=O)C1Cc2ccccc2NC1=O
Properties
Computed Properties
 
Complexity:
277  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.2  

Downstream Synthesis Route
105404-33-9    42139-37-7   
methyl(S)-3-((S)-1-(4-isopropylphenyl)-2-nitroethyl)-2-oxo-1,2,3,4-tetrahydroquinoline-3-carboxylate 
 
methyl(R)-3-((R)-1-(4-isopropylphenyl)-2-nitroethyl)-2-oxo-1,2,3,4-tetrahydroquinoline-3-carboxylate 
 
methyl(RS)-3-((SR)-1-(4-isopropylphenyl)-2-nitroethyl)-2-oxo-1,2,3,4-tetrahydroquinoline-3-carboxylate 

[1]Mukhopadhyay,Soumendranath;Nath,Utpal;Pan,SubhasChandra[AdvancedSynthesisandCatalysis,2017,vol.359,#22,p.3911-3916]

Literature
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SDS
Tags:105404-33-9 Molecular Formula|105404-33-9 MDL|105404-33-9 SMILES|105404-33-9 Methyl 2-oxo-1,2,3,4-tetrahydroquinoline-3-carboxylate