Home Boronic Acids 191089-06-2
191089-06-2,MFCD09037832
Catalog No.:AA002EXS

191089-06-2 | 4-Carboxy-3-methylphenylboronic acid

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Purity
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100mg
98%
in stock  
$42.00   $29.00
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250mg
98%
in stock  
$71.00   $50.00
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1g
98%
in stock  
$193.00   $135.00
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5g
98%
in stock  
$675.00   $472.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002EXS
Chemical Name:
4-Carboxy-3-methylphenylboronic acid
CAS Number:
191089-06-2
Molecular Formula:
C8H9BO4
Molecular Weight:
179.9657
MDL Number:
MFCD09037832
SMILES:
OB(c1ccc(c(c1)C)C(=O)O)O
Properties
Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
2  

Downstream Synthesis Route
191089-06-2    455-14-1   
C15H13BF3NO3 

[1]Zheng,Xiaozhang;Hodgetts,KevinJ.;Brielmann,Harry;Hutchison,Alan;Burkamp,Frank;BrianJones;Blurton,Peter;Clarkson,Robert;Chandrasekhar,Jayaraman;Bakthavatchalam,Rajagopal;DeLombaert,Stephane;Crandall,Marci;Cortright,Daniel;Blum,CharlesA.[BioorganicandMedicinalChemistryLetters,2006,vol.16,#19,p.5217-5221]

191089-06-2   
2-methyl-4-(3-methyl-pyridin-2-yl)-<i>N</i>-(4-trifluoromethyl-phenyl)-benzamide 

[1]Zheng,Xiaozhang;Hodgetts,KevinJ.;Brielmann,Harry;Hutchison,Alan;Burkamp,Frank;BrianJones;Blurton,Peter;Clarkson,Robert;Chandrasekhar,Jayaraman;Bakthavatchalam,Rajagopal;DeLombaert,Stephane;Crandall,Marci;Cortright,Daniel;Blum,CharlesA.[BioorganicandMedicinalChemistryLetters,2006,vol.16,#19,p.5217-5221]

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2006/63167,2006,A1Locationinpatent:Page/Pagecolumn22

[1]Locationinpatent:schemeortableMoreau;Desroy;Genevard;Vongsouthi;Gerusz;LeFralliec;Oliveira;Floquet;Denis;Escaich;Wolf;Busemann;Aschenbrenner[BioorganicandMedicinalChemistryLetters,2008,vol.18,#14,p.4022-4026]

[1]CurrentPatentAssignee:BAYERAG-WO2011/64328,2011,A1Locationinpatent:Page/Pagecolumn74-75

[2]CurrentPatentAssignee:BAYERAG-WO2011/157688,2011,A1Locationinpatent:Page/Pagecolumn104

[3]CurrentPatentAssignee:BAYERAG-WO2012/143329,2012,A1Locationinpatent:Page/Pagecolumn84-85

[4]CurrentPatentAssignee:BAYERAG-WO2012/160029,2012,A1Locationinpatent:Page/Pagecolumn80-81

Literature
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SDS
Tags:191089-06-2 Molecular Formula|191089-06-2 MDL|191089-06-2 SMILES|191089-06-2 4-Carboxy-3-methylphenylboronic acid