Home Amines 1012785-44-2
1012785-44-2,MFCD09746204
Catalog No.:AA00041G
1012785-44-2 | 4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester
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1g
98%
in stock  
$93.00   $65.00
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5g
98%
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$279.00   $195.00
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Technical Information
Catalog Number:
AA00041G
Chemical Name:
4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester
CAS Number:
1012785-44-2
Molecular Formula:
C17H28BNO2
Molecular Weight:
289.2207
MDL Number:
MFCD09746204
IUPAC Name:
N-ethyl-N-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]ethanamine
InChI:
InChI=1S/C17H28BNO2/c1-7-19(8-2)13-14-9-11-15(12-10-14)18-20-16(3,4)17(5,6)21-18/h9-12H,7-8,13H2,1-6H3
InChI Key:
VPXPXAUWTQPYDA-UHFFFAOYSA-N
SMILES:
CCN(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC
Properties
Computed Properties
 
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.221g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.226g/mol
Monoisotopic Mass:
289.221g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1012785-44-2 
N-Ethyl-N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)ethanamine 
AKOS015999384 
ZINC169746424 
AS-3061 
BBV-42423949 
OR310980 
AX8230690 
TC-142191 
ST24025648 
B-6247 
2-[4-(Diethylaminomethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 
4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester 
diethyl({[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl})amine 
Benzenemethanamine, N,N-diethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- 
diethyl({[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl})amine 
N-Ethyl-N-(4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)benzyl)ethanamine 
N-Ethyl-N-{[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}ethanamine 
C17H28BNO2 
AMTB1008 
SCHEMBL3068859 
CTK8B6433 
DTXSID80718237 
KS-000022MZ 
ANW-53446 
MFCD09746204 
Literature
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