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957034-45-6,MFCD08689550
Catalog No.:AA005YXF

957034-45-6 | 2-Methyl-4-trifluoromethylphenylboronic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
96%
in stock  
$19.00   $13.00
- +
1g
96%
in stock  
$35.00   $25.00
- +
5g
96%
in stock  
$161.00   $113.00
- +
100g
96%
in stock  
$3,156.00 $2,209.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005YXF
Chemical Name:
2-Methyl-4-trifluoromethylphenylboronic acid
CAS Number:
957034-45-6
Molecular Formula:
C8H8BF3O2
Molecular Weight:
203.9541
MDL Number:
MFCD08689550
SMILES:
OB(c1ccc(cc1C)C(F)(F)F)O
Properties
Properties
 
BP:
271.9°C at 760 mmHg  
Form:
Solid  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
196  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]Patent:WO2010/15652,2010,A2.Locationinpatent:Page/Pagecolumn90

[1]Patent:US2010/261755,2010,A1.Locationinpatent:Page/Pagecolumn30

[1]JournalofMedicinalChemistry,2011,vol.54,p.8321-8327

[2]Patent:US2013/123258,2013,A1.Locationinpatent:Paragraph0130;0131;0286;0287;0288;0289

[1]Patent:WO2011/163610,2011,A2.Locationinpatent:Page/Pagecolumn175-176

[1]Patent:US2012/302641,2012,A1.Locationinpatent:Page/Pagecolumn22

[2]Patent:US2012/302610,2012,A1.Locationinpatent:Page/Pagecolumn43

Literature
Quotation Request
Company Name:
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Contact Person:
*
Email:
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Quantity Required:
*
Country:
Additional Info:
Submit
SDS
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Tags:957034-45-6 Molecular Formula|957034-45-6 MDL|957034-45-6 SMILES|957034-45-6 2-Methyl-4-trifluoromethylphenylboronic acid
Catalog No.: AA005YXF
957034-45-6,MFCD08689550
957034-45-6 | 2-Methyl-4-trifluoromethylphenylboronic acid
Pack Size： 250mg
Purity： 96%
in stock
$19.00 $13.00
Pack Size： 1g
Purity： 96%
in stock
$35.00 $25.00
Pack Size： 5g
Purity： 96%
in stock
$161.00 $113.00
Pack Size： 100g
Purity： 96%
in stock
$3,156.00 $2,209.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005YXF
Chemical Name: 2-Methyl-4-trifluoromethylphenylboronic acid
CAS Number: 957034-45-6
Molecular Formula: C8H8BF3O2
Molecular Weight: 203.9541
MDL Number: MFCD08689550
SMILES: OB(c1ccc(cc1C)C(F)(F)F)O
Properties
BP: 271.9°C at 760 mmHg  
Form: Solid  
Storage: Inert atmosphere;2-8℃;  
Complexity: 196  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
957034-45-6    17100-58-2    1207536-77-3 

[1]Patent:WO2010/15652,2010,A2.Locationinpatent:Page/Pagecolumn90

58481-11-1    957034-45-6    1251844-13-9 

[1]Patent:US2010/261755,2010,A1.Locationinpatent:Page/Pagecolumn30

957034-45-6    1349820-67-2    1349820-89-8 

[1]JournalofMedicinalChemistry,2011,vol.54,p.8321-8327

[2]Patent:US2013/123258,2013,A1.Locationinpatent:Paragraph0130;0131;0286;0287;0288;0289

957034-45-6    20366-57-8    1353556-05-4 

[1]Patent:WO2011/163610,2011,A2.Locationinpatent:Page/Pagecolumn175-176

957034-45-6    135050-44-1    1414931-53-5 

[1]Patent:US2012/302641,2012,A1.Locationinpatent:Page/Pagecolumn22

[2]Patent:US2012/302610,2012,A1.Locationinpatent:Page/Pagecolumn43

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