2,4,6-TRIISOPROPYLPHENYLBORONIC ACID MET

Product Information

Molecular Formula:
C17H29BO2
Molecular Weight:
276.22
Description
2,4,6-Triisopropylphenylboronic Acid Met is often used in Palladium-catalyzed cross-coupling reactions in medical research. Essential for drug discovery processes, it helps synthesize complex molecular structures used in the treatment of various diseases including cancer.
Synonyms
Dimethyl (2,4,6-triisopropylphenyl)boronate; 2,4,6-Triisopropylphenylboronic acid methyl ester; dimethoxy-[2,4,6-tri(propan-2-yl)phenyl]borane; Boronic acid, B-[2,4,6-tris(1-methylethyl)phenyl]-, dimethyl ester; (2,4,6-Triisopropylphenyl)dimethoxyboron; Dimethyl(2,4,6-triisopropylphenyl)boronate; Boronic acid, [2,4,6-tris(1-methylethyl)phenyl]-, dimethyl ester; 2,4,6-Triisopropylphenylboronic acid met; (2,4,6-triisopropylphenyl)dimethoxyborane; Dimethyl [2,4,6-tri(propan-2-yl)phenyl]boronate; 2,4,6-Triisopropylphenylboronic acid methyl ester, 96%; Boronicacid,B-[2,4,6-tris(1-methylethyl)phenyl]-,dimethylester
IUPAC Name
dimethoxy-[2,4,6-tri(propan-2-yl)phenyl]borane
Canonical SMILES
B(C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C)(OC)OC
InChI
InChI=1S/C17H29BO2/c1-11(2)14-9-15(12(3)4)17(18(19-7)20-8)16(10-14)13(5)6/h9-13H,1-8H3
InChI Key
KRQWDHHDTSORLQ-UHFFFAOYSA-N
Flash Point
>230 °F
Purity
96%
Density
0.913 g/mL at 25 °C
Refractive Index
n20/D 1.484

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
6
Exact Mass
276.2260603 g/mol
Monoisotopic Mass
276.2260603 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
256
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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