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66158-33-6,MFCD00140660
Catalog No.:AA00FD3E

66158-33-6 | 1-Allyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid

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1mg
>95%
1 week  
$299.00   $209.00
- +
5mg
>95%
1 week  
$319.00   $223.00
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500mg
>95%
1 week  
$327.00   $229.00
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1g
>95%
1 week  
$396.00   $277.00
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5g
>95%
1 week  
$759.00   $531.00
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10g
>95%
1 week  
$1,121.00   $785.00
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25g
>95%
1 week  
$2,209.00   $1,546.00
- +
50g
>95%
1 week  
$3,841.00   $2,689.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00FD3E
Chemical Name:
1-Allyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CAS Number:
66158-33-6
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
MDL Number:
MFCD00140660
SMILES:
C=CCn1cccc(c1=O)C(=O)O
Properties
Computed Properties
 
Complexity:
315  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.3  

Downstream Synthesis Route
lithium1-allyl-2-oxo-1,2-dihydropyridine-3-carboxylate 
  66158-33-6 

[1]Giroud,Maude;Dietzel,Uwe;Anselm,Lilli;Banner,David;Kuglstatter,Andreas;Benz,Jörg;Blanc,Jean-Baptiste;Gaufreteau,Delphine;Liu,Haixia;Lin,Xianfeng;Stich,August;Kuhn,Bernd;Schuler,Franz;Kaiser,Marcel;Brun,Reto;Schirmeister,Tanja;Kisker,Caroline;Diederich,François;Haap,Wolfgang[JournalofMedicinalChemistry,2018,vol.61,#8,p.3350-3369]

allyl1-allyl-2-oxo-1,2-dihydropyridine-3-carboxylate 
  66158-33-6 

[1]Giroud,Maude;Dietzel,Uwe;Anselm,Lilli;Banner,David;Kuglstatter,Andreas;Benz,Jörg;Blanc,Jean-Baptiste;Gaufreteau,Delphine;Liu,Haixia;Lin,Xianfeng;Stich,August;Kuhn,Bernd;Schuler,Franz;Kaiser,Marcel;Brun,Reto;Schirmeister,Tanja;Kisker,Caroline;Diederich,François;Haap,Wolfgang[JournalofMedicinalChemistry,2018,vol.61,#8,p.3350-3369]

Literature
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SDS
Tags:66158-33-6 Molecular Formula|66158-33-6 MDL|66158-33-6 SMILES|66158-33-6 1-Allyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid