Home Boronic Acids 1001200-60-7
1001200-60-7,MFCD18729904
Catalog No.:AA0000WW
1001200-60-7 | 1,3,2-Dioxaborolane, 2-(4-fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-
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1g
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5g
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  • Technical Information
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Technical Information
Catalog Number:
AA0000WW
Chemical Name:
1,3,2-Dioxaborolane, 2-(4-fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-
CAS Number:
1001200-60-7
Molecular Formula:
C13H18BFO2
Molecular Weight:
236.0902
MDL Number:
MFCD18729904
IUPAC Name:
2-(4-fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BFO2/c1-9-8-10(6-7-11(9)15)14-16-12(2,3)13(4,5)17-14/h6-8H,1-5H3
InChI Key:
UNTVLIKQVDPHFS-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1C)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.138g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.093g/mol
Monoisotopic Mass:
236.138g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1001200-60-7 
2-(4-Fluoro-3-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 
ANW-53320 
AKOS015999554 
ZINC169747494 
AS-2631 
ST2403951 
TC-142065 
B-6206 
1,3,2-Dioxaborolane, 2-(4-fluoro-3-methylphenyl)-4,4,5,5-tetramethyl- 
C13H18BFO2 
4-Fluoro-3-methylphenylboronic acid pinacol ester 
4-Fluoro-3-methylphenylboronic acid, pinacol ester 
MFCD18729904 
AMTB633 
SCHEMBL14616470 
CTK8B6347 
DTXSID50718421 
KS-000022ET 
Literature
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