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13337-69-4,MFCD09834787
Catalog No.:AA0014OL

13337-69-4 | 1,2,3,4-Tetrahydroquinoline-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
97%
2 weeks  
$888.00   $621.00
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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:
AA0014OL
Chemical Name:
1,2,3,4-Tetrahydroquinoline-4-carboxylic acid
CAS Number:
13337-69-4
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD09834787
SMILES:
OC(=O)C1CCNc2c1cccc2
Properties
Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.5  

Downstream Synthesis Route

[1]ChemistryofHeterocyclicCompounds,1988,vol.24,p.65-67    KhimiyaGeterotsiklicheskikhSoedinenii,1988,vol.24,p.77-79

[2]Patent:WO2006/91674,2006,A1.Locationinpatent:Page/Pagecolumn84

[3]MonatsheftefurChemie,1881,vol.2,p.29    MonatsheftefuerChemie,1882,vol.3,p.61Anm.2

[4]Patent:US2006/128689,2006,A1.Locationinpatent:Page/Pagecolumn21-22

[5]Patent:WO2007/85558,2007,A1.Locationinpatent:Page/Pagecolumn64-65

[6]JournalofMedicinalChemistry,2013,vol.56,p.9897-9919

[1]CurrentPatentAssignee:THEROCKEFELLERUNIVERSITY-WO2017/123518,2017,A1Locationinpatent:Paragraph061

Literature

Title: Methyl 4-methyl-2-oxo-1,2,5,6-tetra-hydro-4H-pyrrolo[3,2,1-ij]quinoline-6-carboxyl-ate.

Journal: Acta crystallographica. Section E, Structure reports online 20090801

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SDS
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Tags:13337-69-4 Molecular Formula|13337-69-4 MDL|13337-69-4 SMILES|13337-69-4 1,2,3,4-Tetrahydroquinoline-4-carboxylic acid