Home Boronic Acids 1004294-80-7
1004294-80-7,MFCD11849992
Catalog No.:AA0001VS
1004294-80-7 | 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$34.00   $24.00
- +
250mg
97%
in stock  
$58.00   $41.00
- +
500mg
97%
in stock  
$77.00   $54.00
- +
1g
97%
in stock  
$117.00   $82.00
- +
5g
95%
in stock  
$544.00   $381.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA0001VS
Chemical Name:
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one
CAS Number:
1004294-80-7
Molecular Formula:
C14H18BNO3
Molecular Weight:
259.1086
MDL Number:
MFCD11849992
IUPAC Name:
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C14H18BNO3/c1-13(2)14(3,4)19-15(18-13)10-6-5-9-8-16-12(17)11(9)7-10/h5-7H,8H2,1-4H3,(H,16,17)
InChI Key:
BUORFAFSDKNVNY-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.138g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.112g/mol
Monoisotopic Mass:
259.138g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1004294-80-7 
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one 
DTXSID30676818 
BUORFAFSDKNVNY-UHFFFAOYSA-N 
BCP23447 
ZX-RL002026 
ANW-59775 
BBL103963 
STL557773 
AKOS015899711 
ZINC169745218 
ACN-000145 
1-ISOINDOLINONE-6-BORONIC ACID PINACOL ESTER 
CS-W003949 
FCH2840186 
LS41140 
PB29896 
QC-2504 
RP29234 
AN-26052 
BC000936 
DS-12792 
OR305287 
6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1H-isoindol-1-one 
SC-83923 
SY009571 
AB0069230 
AX8163673 
DB-012286 
TC-148520 
4CH-008925 
AM20120475 
BB 0261322 
FT-0690162 
AK-37747 
ST24029581 
Z3788 
MFCD11849992 (95%) 
Q-3779 
(2,3-Dihydro-3-oxo-1H-isoindol-5-yl)boronic acid 
J-518009 
S10-0048 
I14-11603 
ISOINDOLIN-1-ONE-6-BORONIC ACID PINACOL ESTER 
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)iso 
1H-Isoindol-1-one, 2,3-dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- 
(3-Oxo-2,3-dihydro-1H-isoindol-5-yl)boronic, pinacol ester 
2,3-DIHYDRO-1H-ISOINDOL-1-ONE-6-BORONIC ACID PINACOL ESTER 
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-isoindolinone 
6-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-isoindol-1-one 
6-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydroisoindol-1-one 
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroisoindol-1-one 
C14H18BNO3 
A16202 
MFCD11849992 
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1H-isoindol-1-one 
SCHEMBL392410 
CTK7H6335 
Literature
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