4,5-Dimethoxy-2-(methoxycarbonyl)phenylboronic acid

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Product Information

Molecular Formula:
C10H13BO6
Molecular Weight:
240.02
Description
4,5-Dimethoxy-2-(methoxycarbonyl)phenylboronic acid is an indispensable and highly significant compound within the biomedical realm and exhibits remarkable effectiveness in combating specific maladies and conditions. Its exceptional therapeutic potential lies within its capability to act as a building block in the synthesis of pharmaceuticals specifically targeting distinct receptors or enzymes instrumental in diverse physiological phenomena. Owing to its distinctive chemical configuration and inherent properties, this compound holds promise as a prospective remedy for tailored therapeutic interventions.
Synonyms
(4,5-Dimethoxy-2-(methoxycarbonyl)phenyl)boronic acid; (4,5-dimethoxy-2-methoxycarbonylphenyl)boronic acid; [4,5-Dimethoxy-2-(methoxycarbonyl)phenyl]boronic acid; (4,5-Dimethoxy-2-(methoxycarbonyl)phenyl)boronicacid; 4,5-Dimethoxy-2-(methoxycarbonyl)benzeneboronic acid; 4,5-Dimethoxy-2-(methoxycarbonyl)phenylboronic acid
IUPAC Name
(4,5-dimethoxy-2-methoxycarbonylphenyl)boronic acid
Canonical SMILES
B(C1=CC(=C(C=C1C(=O)OC)OC)OC)(O)O
InChI
InChI=1S/C10H13BO6/c1-15-8-4-6(10(12)17-3)7(11(13)14)5-9(8)16-2/h4-5,13-14H,1-3H3
InChI Key
CELMPXWFMDIKQI-UHFFFAOYSA-N
Flash Point
Not applicable

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
5
Exact Mass
240.0805183 g/mol
Monoisotopic Mass
240.0805183 g/mol
Topological Polar Surface Area
85.2Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
259
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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