Home Amines 5427-99-6
5427-99-6,MFCD00771928
Catalog No.:AA00E0TT

5427-99-6 | 2-[(2-Nitrophenyl)amino]acetic acid

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250mg
95%
1 week  
$98.00   $69.00
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1g
95%
1 week  
$260.00   $182.00
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5g
95%
1 week  
$908.00   $636.00
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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:
AA00E0TT
Chemical Name:
2-[(2-Nitrophenyl)amino]acetic acid
CAS Number:
5427-99-6
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
MDL Number:
MFCD00771928
SMILES:
OC(=O)CNc1ccccc1[N+](=O)[O-]
NSC Number:
12787
Properties
Computed Properties
 
Complexity:
226  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Estrin,Darío;Fabian,Lucas;Gómez,Natalia;Moglioni,Albertina;Salvatori,Melina;TavernaPorro,Marisa;Turk,Gabriela[EuropeanJournalofMedicinalChemistry,2020,vol.188]

[2]Ploechl[ChemischeBerichte,1886,vol.19,p.10]

[1]Locationinpatent:schemeortableSmil,DavidV.;Manku,Sukhdev;Chantigny,YvesA.;Leit,Silvana;Wahhab,Amal;Yan,TheresaP.;Fournel,Marielle;Maroun,Christiane;Li,Zuomei;Lemieux,Anne-Marie;Nicolescu,Alina;Rahil,Jubrail;Lefebvre,Sylvain;Panetta,Anthony;Besterman,JeffreyM.;Déziel,Robert[BioorganicandMedicinalChemistryLetters,2009,vol.19,#3,p.688-692]

[2]Estrin,Darío;Fabian,Lucas;Gómez,Natalia;Moglioni,Albertina;Salvatori,Melina;TavernaPorro,Marisa;Turk,Gabriela[EuropeanJournalofMedicinalChemistry,2020,vol.188]

[3]Harvey,IanW.;McFarlane,MichaelD.;Moody,DavidJ.;Smith,DavidM.[JournaloftheChemicalSociety.PerkintransactionsI,1988,p.681-690]

[4]Holley;Holley[JournaloftheAmericanChemicalSociety,1952,vol.74,p.5445,5446,5448]

[5]DudashJr.,Joseph;Zhang,Yongzheng;Moore,JohnB.;Look,Richard;Liang,Yin;Beavers,MaryPat;Conway,BruceR.;Rybczynski,PhilipJ.;Demarest,KeithT.[BioorganicandMedicinalChemistryLetters,2005,vol.15,#21,p.4790-4793]

[6]CurrentPatentAssignee:THEUNIVERSITYOFTEXASSYSTEM-WO2017/100525,2017,A1Locationinpatent:Paragraph00271

Literature

Title: N-acyl-N-carboxymethyl-2-nitroaniline and its analogues: a new class of water-soluble photolabile precursor of carboxylic acids.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20120301

Title: Concurrent detection of circulating minor histocompatibility antigen-specific CD8+ T cells in SCT recipients by combinatorial encoding MHC multimers.

Journal: PloS one 20110101

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SDS
Tags:5427-99-6 Molecular Formula|5427-99-6 MDL|5427-99-6 SMILES|5427-99-6 2-[(2-Nitrophenyl)amino]acetic acid