Home Boronic Acids 1025495-85-5
1025495-85-5,MFCD08572133
Catalog No.:AA0007LV
1025495-85-5 | 4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenylboronic acid
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1g
96%
in stock  
$229.00   $160.00
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5g
96%
in stock  
$730.00   $511.00
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10g
96%
in stock  
$1,191.00   $834.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0007LV
Chemical Name:
4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenylboronic acid
CAS Number:
1025495-85-5
Molecular Formula:
C11H13BN2O2
Molecular Weight:
216.0441
MDL Number:
MFCD08572133
IUPAC Name:
[4-(3,5-dimethylpyrazol-1-yl)phenyl]boronic acid
InChI:
InChI=1S/C11H13BN2O2/c1-8-7-9(2)14(13-8)11-5-3-10(4-6-11)12(15)16/h3-7,15-16H,1-2H3
InChI Key:
OJUOPNGDUVRDFU-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C)c1ccc(cc1)B(O)O
Properties
Computed Properties
 
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.107g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.047g/mol
Monoisotopic Mass:
216.107g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1025495-85-5 
(4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenyl)boronic acid 
MFCD08572133 
SBB025614 
STK352549 
AKOS003237311 
ZINC169746476 
MCULE-8740778581 
TR-033847 
ST24020474 
ST45134211 
Z6535 
4-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)PHENYLBORONIC ACID 
EN300-92482 
A-4195 
4-(3,5-dimethylpyrazol-1-yl)phenylboronic acid 
I04-2424 
boronic acid, [4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]- 
Boronic acid, B-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]- 
C11H13BN2O2 
(4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenyl)boronicacid 
N/A 
[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]boronic acid 
SCHEMBL15332028 
CTK4A1186 
DTXSID00586298 
ACMC-209822 
ALBB-011835 
ANW-14712 
Literature
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