1201644-36-1,MFCD18383956
Catalog No.:AA009452

1201644-36-1 | 2-Methoxyquinoline-6-boronic acid, pinacol ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$42.00   $30.00
- +
250mg
98%
in stock  
$74.00   $52.00
- +
1g
98%
in stock  
$187.00   $131.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009452
Chemical Name:
2-Methoxyquinoline-6-boronic acid, pinacol ester
CAS Number:
1201644-36-1
Molecular Formula:
C16H20BNO3
Molecular Weight:
285.1459
MDL Number:
MFCD18383956
SMILES:
COc1ccc2c(n1)ccc(c2)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
372  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]CurrentPatentAssignee:MERCK&COINC-US2010/81643,2010,A1Locationinpatent:Page/Pagecolumn43

[2]CurrentPatentAssignee:MERCK&COINC-WO2010/47982,2010,A1Locationinpatent:Page/Pagecolumn87

[3]CurrentPatentAssignee:MERCK&COINC-WO2010/51206,2010,A1Locationinpatent:Page/Pagecolumn88-89

[4]Vidadala,RamaSubbaRao;Ojo,KayodeK.;Johnson,StevenM.;Zhang,Zhongsheng;Leonard,StephenE.;Mitra,Arinjay;Choi,Ryan;Reid,MollyC.;Keyloun,KatelynR.;Fox,AnnaM.W.;Kennedy,Mark;Silver-Brace,Tiffany;Hume,JenC.C.;Kappe,Stefan;Verlinde,ChristopheL.M.J.;Fan,Erkang;Merritt,EthanA.;VanVoorhis,WesleyC.;Maly,DustinJ.[EuropeanJournalofMedicinalChemistry,2014,vol.74,p.562-573]

Literature
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Additional Info:
SDS
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Tags:1201644-36-1 Molecular Formula|1201644-36-1 MDL|1201644-36-1 SMILES|1201644-36-1 2-Methoxyquinoline-6-boronic acid, pinacol ester
Catalog No.: AA009452
1201644-36-1,MFCD18383956
1201644-36-1 | 2-Methoxyquinoline-6-boronic acid, pinacol ester
Pack Size: 100mg
Purity: 98%
in stock
$42.00 $30.00
Pack Size: 250mg
Purity: 98%
in stock
$74.00 $52.00
Pack Size: 1g
Purity: 98%
in stock
$187.00 $131.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA009452
Chemical Name: 2-Methoxyquinoline-6-boronic acid, pinacol ester
CAS Number: 1201644-36-1
Molecular Formula: C16H20BNO3
Molecular Weight: 285.1459
MDL Number: MFCD18383956
SMILES: COc1ccc2c(n1)ccc(c2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity: 372  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 21  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
99455-05-7    73183-34-3    1201644-36-1 

[1]CurrentPatentAssignee:MERCK&COINC-US2010/81643,2010,A1Locationinpatent:Page/Pagecolumn43

[2]CurrentPatentAssignee:MERCK&COINC-WO2010/47982,2010,A1Locationinpatent:Page/Pagecolumn87

[3]CurrentPatentAssignee:MERCK&COINC-WO2010/51206,2010,A1Locationinpatent:Page/Pagecolumn88-89

[4]Vidadala,RamaSubbaRao;Ojo,KayodeK.;Johnson,StevenM.;Zhang,Zhongsheng;Leonard,StephenE.;Mitra,Arinjay;Choi,Ryan;Reid,MollyC.;Keyloun,KatelynR.;Fox,AnnaM.W.;Kennedy,Mark;Silver-Brace,Tiffany;Hume,JenC.C.;Kappe,Stefan;Verlinde,ChristopheL.M.J.;Fan,Erkang;Merritt,EthanA.;VanVoorhis,WesleyC.;Maly,DustinJ.[EuropeanJournalofMedicinalChemistry,2014,vol.74,p.562-573]

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