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Home Amines 129042-60-0
129042-60-0,MFCD00736965
Catalog No.:AA000YPQ

129042-60-0 | 3-Amino-3-benzo[1,3]dioxol-5-yl-propionic acid

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Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$75.00   $53.00
- +
1g
95%
in stock  
$169.00   $118.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000YPQ
Chemical Name:
3-Amino-3-benzo[1,3]dioxol-5-yl-propionic acid
CAS Number:
129042-60-0
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD00736965
SMILES:
OC(=O)CC(c1ccc2c(c1)OCO2)N
Properties
Computed Properties
 
Complexity:
246  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:UBEINDUSTRIESLIMITED-EP1621529,2006,A1Locationinpatent:Page/Pagecolumn42

[2]Bea,Han-Seop;Park,Hye-Jeong;Lee,Sang-Hyeup;Yun,Hyungdon[ChemicalCommunications,2011,vol.47,#20,p.5894-5896]

[3]Tasnadi,Gabor;Forro,Eniko;Fueloep,Ferenc[TetrahedronAsymmetry,2008,vol.19,#17,p.2072-2077]

[4]Dallemagne,Patrick;Rault,Sylvain;Pilo,JuanCarlos;Foloppe,MariePaule;Robba,Max[TetrahedronLetters,1991,vol.32,#44,p.6327-6328]

[5]Zablocki;Rico;Garland;Rogers;Williams;Schretzman;Rao;Bovy;Tjoeng;Lindmark;Toth;Zupec;McMackins;Adams;Miyano;Markos;Milton;Paulson;Herin;etal.[JournalofMedicinalChemistry,1995,vol.38,#13,p.2378-2394]

[6]Hoekstra,WilliamJ.;Maryanoff,BruceE.;Damiano,BruceP.;Andrade-Gordon,Patricia;Cohen,JudithH.;Costanzo,MichaelJ.;Haertlein,BarbaraJ.;Hecker,LeonardR.;Hulshizer,BeckyL.;Kauffman,JackA.;Keane,Patricia;McComsey,DavidF.;Mitchell,JohnA.;Scott,Lorraine;Shah,RekhaD.;Yabut,StephenC.[JournalofMedicinalChemistry,1999,vol.42,#25,p.5254-5265]

[7]Wehner,Volkmar;Blum,Horst;Kurz,Michael;Stilz,HansUlrich[Synthesis,2002,#14,p.2023-2036]

[1]Dallemagne,P.;Pilo,J.C.;Rault,S.;Robba,M.[BulletindelaSocieteChimiquedeFrance,1993,vol.130,#1,p.121-124]

[1]Dallemagne,Patrick;Rault,Sylvain;Pilo,JuanCarlos;Foloppe,MariePaule;Robba,Max[TetrahedronLetters,1991,vol.32,#44,p.6327-6328]

[1]Tasnadi,Gabor;Forro,Eniko;Fueloep,Ferenc[TetrahedronAsymmetry,2008,vol.19,#17,p.2072-2077]

[2]Zablocki;Rico;Garland;Rogers;Williams;Schretzman;Rao;Bovy;Tjoeng;Lindmark;Toth;Zupec;McMackins;Adams;Miyano;Markos;Milton;Paulson;Herin;etal.[JournalofMedicinalChemistry,1995,vol.38,#13,p.2378-2394]

129042-60-0    103-80-0   
3-benzo1,3dioxol-5-yl-3-phenylacetylamino-propionicacid 

[1]Hoekstra,WilliamJ.;Maryanoff,BruceE.;Damiano,BruceP.;Andrade-Gordon,Patricia;Cohen,JudithH.;Costanzo,MichaelJ.;Haertlein,BarbaraJ.;Hecker,LeonardR.;Hulshizer,BeckyL.;Kauffman,JackA.;Keane,Patricia;McComsey,DavidF.;Mitchell,JohnA.;Scott,Lorraine;Shah,RekhaD.;Yabut,StephenC.[JournalofMedicinalChemistry,1999,vol.42,#25,p.5254-5265]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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