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104883-49-0,MFCD00123305
Catalog No.:AA007X8V

104883-49-0 | 3-Aminooctanoic acid

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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:
AA007X8V
Chemical Name:
3-Aminooctanoic acid
CAS Number:
104883-49-0
Molecular Formula:
C8H17NO2
Molecular Weight:
159.2261
MDL Number:
MFCD00123305
SMILES:
CCCCCC(CC(=O)O)N
NSC Number:
165010
Properties
Computed Properties
 
Complexity:
115  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-1.1  

Downstream Synthesis Route

[1]Bonnard,Isabelle;Rolland,Marc;Salmon,Jean-Marie;Debiton,Eric;Barthomeuf,Chantal;Banaigs,Bernard[JournalofMedicinalChemistry,2007,vol.50,#6,p.1266-1279]

[2]Gerwick,WilliamH.;Jiang,ZhiD.;Agarwal,SantoshK.;Farmer,BennettT.[Tetrahedron,1992,vol.48,#12,p.2313-2324]

Literature

Title: Lobocyclamides A-C, lipopeptides from a cryptic cyanobacterial mat containing Lyngbya confervoides.

Journal: The Journal of organic chemistry 20021115

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SDS
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