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845872-30-2,MFCD13181970
Catalog No.:AA00G3AN

845872-30-2 | 2-Methylbenzooxazole-5-boronic acid, pinacol ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$37.00   $26.00
- +
250mg
97%
in stock  
$49.00   $34.00
- +
1g
95%
in stock  
$124.00   $87.00
- +
5g
97%
in stock  
$393.00   $275.00
- +
10g
97%
in stock  
$678.00   $475.00
- +
25g
97%
in stock  
$1,345.00 $942.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00G3AN
Chemical Name:
2-Methylbenzooxazole-5-boronic acid, pinacol ester
CAS Number:
845872-30-2
Molecular Formula:
C14H18BNO3
Molecular Weight:
259.1086
MDL Number:
MFCD13181970
SMILES:
Cc1oc2c(n1)cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
345  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route
845872-30-2    1620098-61-4   
C30H30F6N6O6S 

[1]Hong,Fang-Tsao;Norman,MarkH.;Ashton,KateS.;Bartberger,MichaelD.;Chen,Jie;Chmait,Samer;Cupples,Rod;Fotsch,Christopher;Jordan,StevenR.;Lloyd,DavidJ.;Sivits,Glenn;Tadesse,Seifu;Hale,Clarence;St.Jean,DavidJ.[JournalofMedicinalChemistry,2014,vol.57,#14,p.5949-5964]

845872-30-2   
methyl6-amino-2-bromo-5-chloropyridine-4-carboxylate 
 
methyl6-amino-5-chloro-2-(2-methyl-1,3-benzoxazol-5-yl)pyrimidine-4-carboxylate 

[1]CurrentPatentAssignee:BAYERAG-US9179676,2015,B2Locationinpatent:Page/Pagecolumn84

[1]OrganicLetters,2019,vol.21,p.8158-8163

845872-30-2   
tert-butyl(3S)-3-methyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydropyridine-1(2H)-carboxylate 
 
tert-butyl(3S)-3-methyl-6-(2-methyl-1,3-benzoxazol-5-yl)-3,4-dihydro-2H-pyridine-1-carboxylate 

[1]CurrentPatentAssignee:TANGOTHERAPEUTICS-WO2022/26892,2022,A1Locationinpatent:Paragraph1622

[2]CurrentPatentAssignee:TANGOTHERAPEUTICS-WO2022/26892,2022,A1Locationinpatent:Paragraph1622

Literature
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SDS
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Tags:845872-30-2 Molecular Formula|845872-30-2 MDL|845872-30-2 SMILES|845872-30-2 2-Methylbenzooxazole-5-boronic acid, pinacol ester
Catalog No.: AA00G3AN
845872-30-2,MFCD13181970
845872-30-2 | 2-Methylbenzooxazole-5-boronic acid, pinacol ester
Pack Size： 100mg
Purity： 97%
in stock
$37.00 $26.00
Pack Size： 250mg
Purity： 97%
in stock
$49.00 $34.00
Pack Size： 1g
Purity： 95%
in stock
$124.00 $87.00
Pack Size： 5g
Purity： 97%
in stock
$393.00 $275.00
Pack Size： 10g
Purity： 97%
in stock
$678.00 $475.00
Pack Size： 25g
Purity： 97%
in stock
$1,345.00 $942.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00G3AN
Chemical Name: 2-Methylbenzooxazole-5-boronic acid, pinacol ester
CAS Number: 845872-30-2
Molecular Formula: C14H18BNO3
Molecular Weight: 259.1086
MDL Number: MFCD13181970
SMILES: Cc1oc2c(n1)cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity: 345  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
845872-30-2    1620098-61-4   
C30H30F6N6O6S 

[1]Hong,Fang-Tsao;Norman,MarkH.;Ashton,KateS.;Bartberger,MichaelD.;Chen,Jie;Chmait,Samer;Cupples,Rod;Fotsch,Christopher;Jordan,StevenR.;Lloyd,DavidJ.;Sivits,Glenn;Tadesse,Seifu;Hale,Clarence;St.Jean,DavidJ.[JournalofMedicinalChemistry,2014,vol.57,#14,p.5949-5964]

845872-30-2   
methyl6-amino-2-bromo-5-chloropyridine-4-carboxylate 
 
methyl6-amino-5-chloro-2-(2-methyl-1,3-benzoxazol-5-yl)pyrimidine-4-carboxylate 

[1]CurrentPatentAssignee:BAYERAG-US9179676,2015,B2Locationinpatent:Page/Pagecolumn84

5676-56-2    73183-34-3    845872-30-2 

[1]OrganicLetters,2019,vol.21,p.8158-8163

845872-30-2   
tert-butyl(3S)-3-methyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydropyridine-1(2H)-carboxylate 
 
tert-butyl(3S)-3-methyl-6-(2-methyl-1,3-benzoxazol-5-yl)-3,4-dihydro-2H-pyridine-1-carboxylate 

[1]CurrentPatentAssignee:TANGOTHERAPEUTICS-WO2022/26892,2022,A1Locationinpatent:Paragraph1622

[2]CurrentPatentAssignee:TANGOTHERAPEUTICS-WO2022/26892,2022,A1Locationinpatent:Paragraph1622

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