Benzoicacid, 3-borono-5-bromo-

Product Information

Molecular Formula:
C7H6 B Br O4
Molecular Weight:
244.83514
Description
Benzoicacid, 3-borono-5-bromo- demonstrates sheer indispensability in the biomedical industry as a pivotal catalyst for synthesizing a wide range of pharmaceutical drugs. Its unparalleled and distinctive borono and bromo functionalities bestow it with remarkable medicinal attributes, rendering it an exceptional reactant in pioneering therapeutic explorations. By encompassing a key role in combating multifaceted afflictions including cancers, bacterial and fungal infections, as well as inflammatory disorders, this compound exhibits unfathomable versatility and promising prospects.
Synonyms
3-BROMO-5-CARBOXYBENZENEBORONIC ACID 97; 3-BROMO-5-CARBOXYBENZENEBORONIC ACID; 3-BROMO-5-CARBOXYPHENYLBORONIC ACID; 3-Bromo-5-carboxybenzeneboronic acid 97%; 3-Borono-5-bromobenzoic acid
IUPAC Name
3-borono-5-bromobenzoic acid
Canonical SMILES
B(C1=CC(=CC(=C1)Br)C(=O)O)(O)O
InChI
InChI=1S/C7H6BBrO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,12-13H,(H,10,11)
InChI Key
CWBLIPMCDMSOFX-UHFFFAOYSA-N
Melting Point
152-158 °C
Purity
98%

Computed Properties

Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
243.95425 g/mol
Monoisotopic Mass
243.95425 g/mol
Topological Polar Surface Area
77.8Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
199
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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