Benzene-1,4-diboronic acid-bis-MIDA ester

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Product Information

Molecular Formula:
C16H18B2N2O8
Molecular Weight:
387.94
Description
Benzene-1,4-diboronic acid-bis-MIDA ester is an incredibly proficient molecule extensively employed in the biomedical arena owing to its remarkable capacity as a pharmacological contender. Demonstrating considerable potential in ameliorating diverse maladies by functioning as a targeted therapeutic delivery medium. This remarkable compound manifests exceptional steadfastness and solubility, rendering it an indispensable instrument within the realms of pharmaceutical exploration and drug advancement.
Synonyms
Benzene-1,4-diboronic acid-bis-MIDA ester
IUPAC Name
6-methyl-2-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenyl]-1,3,6,2-dioxazaborocane-4,8-dione
Canonical SMILES
B1(OC(=O)CN(CC(=O)O1)C)C2=CC=C(C=C2)B3OC(=O)CN(CC(=O)O3)C
InChI
InChI=1S/C16H18B2N2O8/c1-19-7-13(21)25-17(26-14(22)8-19)11-3-5-12(6-4-11)18-27-15(23)9-20(2)10-16(24)28-18/h3-6H,7-10H2,1-2H3
InChI Key
WDGUCEFOPMPYPL-UHFFFAOYSA-N
Flash Point
Not applicable

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
10
Rotatable Bond Count
2
Exact Mass
388.1249259 g/mol
Monoisotopic Mass
388.1249259 g/mol
Topological Polar Surface Area
112Ų
Heavy Atom Count
28
Formal Charge
0
Complexity
546
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)

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The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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