Home Boronic Acids 1025719-23-6
1025719-23-6,MFCD12828677
Catalog No.:AA0007PF
1025719-23-6 | 1-Methyl-3-(trifluoromethyl)pyrazole-5-boronic acid pinacol ester
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100mg
95%
in stock  
$64.00   $45.00
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250mg
95%
in stock  
$124.00   $87.00
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1g
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in stock  
$247.00   $173.00
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5g
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$741.00   $519.00
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Technical Information
Catalog Number:
AA0007PF
Chemical Name:
1-Methyl-3-(trifluoromethyl)pyrazole-5-boronic acid pinacol ester
CAS Number:
1025719-23-6
Molecular Formula:
C11H16BF3N2O2
Molecular Weight:
276.0631
MDL Number:
MFCD12828677
IUPAC Name:
1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyrazole
InChI:
InChI=1S/C11H16BF3N2O2/c1-9(2)10(3,4)19-12(18-9)8-6-7(11(13,14)15)16-17(8)5/h6H,1-5H3
InChI Key:
CQKAWCKCEPHXAE-UHFFFAOYSA-N
SMILES:
FC(c1cc(n(n1)C)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Computed Properties
 
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.126g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.066g/mol
Monoisotopic Mass:
276.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1025719-23-6 
1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)-1H-pyrazole 
ANW-52657 
MFCD12022323 
STL415186 
AKOS015921241 
ZINC169743612 
AB65202 
MCULE-7103979778 
BC000021 
CS-13375 
CS-0028801 
1-METHYL-3-(TRIFLUOROMETHYL)PYRAZOLE-5-BORONIC ACID PINACOL ESTER 
FT-0724176 
ST24021352 
A-4201 
1-Methyl-3-trifluoromethylpyrazole-5-boronic acid pinacol ester, 97% 
1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-BORONIC ACID PINACOL ESTER 
1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- 3-(trifluoromethyl)-1H-pyrazole 
1H-Pyrazole, 1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)- 
1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyrazole 
1-Methyl-3-trifluoromethylpyrazole-5-boronic acid pinacol ester 
1-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)-1H-pyrazole 
SCHEMBL15635350 
CTK4A1242 
DTXSID30674177 
CQKAWCKCEPHXAE-UHFFFAOYSA-N 
1-Methyl-3-trifluoromethylpyrazole-5-boronic acid, pinacol ester 
Literature
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