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13305-09-4,MFCD29919631
Catalog No.:AA019EN6

13305-09-4 | Methyl 2-hydroxy-2-(4-nitrophenyl)acetate

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100mg
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$15.00   $10.00
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250mg
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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:
AA019EN6
Chemical Name:
Methyl 2-hydroxy-2-(4-nitrophenyl)acetate
CAS Number:
13305-09-4
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
MDL Number:
MFCD29919631
SMILES:
COC(=O)C(c1ccc(cc1)[N+](=O)[O-])O
Properties
Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2020/123882,2020,A1Locationinpatent:Page/Pagecolumn57

[2]Chen,Bifeng;Wang,Peng;Jin,Qingqing;Tang,Xinjing[OrganicandBiomolecularChemistry,2014,vol.12,#30,p.5629-5633]

[3]CurrentPatentAssignee:ASANABIOSCIENCESLLC-WO2015/38426,2015,A1Locationinpatent:Page/Pagecolumn54;94;95

[4]Guo,Xuefeng;Chen,Yiming;Seto,ChristopherT.[BioorganicandMedicinalChemistry,2018,vol.26,#14,p.3939-3946]

[5]Zhu,Qing;Girish,Aparna;Chattopadhaya,Souvik;Yao,ShaoQ[ChemicalCommunications,2004,#13,p.1512-1513]

[6]CurrentPatentAssignee:ELUCIDAONCOLOGY-WO2022/93800,2022,A2Locationinpatent:Paragraph00452;00456;00477;00480

[7]CurrentPatentAssignee:ELUCIDAONCOLOGY-WO2022/93800,2022,A2Locationinpatent:Paragraph00452;00456;00477;00480

[8]Fosdick;Wessinger[JournaloftheAmericanChemicalSociety,1938,vol.60,p.1465]

[1]Banerjee,SudheerK.;Shanker,R.;Sachdeva,OmP.[ZeitschriftfurNaturforschung,TeilB:AnorganischeChemie,OrganischeChemie,1986,vol.41,#4,p.467-472]

[2]Chen,Chien-Tien;Bettigeri,Sampada;Weng,Shiue-Shien;Pawar,VijayD.;Lin,Ya-Hui;Liu,Cheng-Yuan;Lee,Way-Zen[JournalofOrganicChemistry,2007,vol.72,#22,p.8175-8185]

[1]Bui-Nguyen,Mai-Huong;Dahn,Hans;McGarrity,JohnF.[HelveticaChimicaActa,1980,vol.63,#1,p.63-75]

[1]Fosdick;Wessinger[JournaloftheAmericanChemicalSociety,1938,vol.60,p.1465]

[1]Lawrence,NicholasJ.;Bushell,SimonM.[TetrahedronLetters,2000,vol.41,#22,p.4507-4512]

Literature
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SDS
Tags:13305-09-4 Molecular Formula|13305-09-4 MDL|13305-09-4 SMILES|13305-09-4 Methyl 2-hydroxy-2-(4-nitrophenyl)acetate