5-cyano-3-pyridinyl boronic acid

Product Information

Molecular Formula:
C6H5BN2O2
Molecular Weight:
147.93
Description
5-cyano-3-pyridinyl boronic acid is an indispensable foundational fragment during the creation of groundbreaking medicaments and pharmaceutical intermediates. Profoundly endowed with unique attributes, this compound emerges as an optimal contender in tackling an array of afflictions, encompassing malignant tumors and inflammatory maladies. Leveraging its multifaceted utilities, this exceptional product substantiates its irreplaceable involvement in propelling biomedical inquiry and the evolution of medicinal breakthroughs.
Synonyms
5-Cyano-3-pyridinylboronic acid; 5-Cyanopyridine-3-boronic acid; (5-cyanopyridin-3-yl)boronic acid; 5-CYANO-3-PYRIDINYL BORONIC ACID; 5-cyanopyridin-3-ylboronic acid; BORONIC ACID, (5-CYANO-3-PYRIDINYL)-; 5-Cyano-3-pyridinylboronicacid; Boronic acid,B-(5-cyano-3-pyridinyl)-; 3-cyanopyridin-5-ylboronic acid; 5-Cyanopyridin-3-yl-3-boronic acid; 5-cyano-3-pyridinyl boronic acid
IUPAC Name
(5-cyanopyridin-3-yl)boronic acid
Canonical SMILES
B(C1=CC(=CN=C1)C#N)(O)O
InChI
InChI=1S/C6H5BN2O2/c8-2-5-1-6(7(10)11)4-9-3-5/h1,3-4,10-11H
InChI Key
CYEXXDYQJPRMIQ-UHFFFAOYSA-N
Flash Point
Not applicable

Safety Information

Hazards
H315 - H318 - H335
Precautionary Statement
P261 - P280 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
148.0444076 g/mol
Monoisotopic Mass
148.0444076 g/mol
Topological Polar Surface Area
77.1Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
177
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

Patents

Publication Number Title Priority Date
CN-113845515-A Aromatic heterocyclic structure-containing dimethyl biphenyl diaryl pyrimidine derivative and preparation method and application thereof 2021-09-03
CN-113461666-A Biphenyl diaryl methyl pyrimidine derivative containing aromatic heterocyclic structure and preparation method thereof 2021-05-06
US-2021230153-A1 Aryl hydrocarbon receptor (ahr) agonists and uses thereof 2019-12-20
WO-2021127301-A1 4-phenyl-n-(phenyl)thiazol-2-amine derivatives and related compounds as aryl hydrocarbon receptor (ahr) agonists for the treatment of e.g. angiogenesis implicated or inflammatory disorders 2019-12-20
WO-2021099837-A1 Adenosine receptor antagonist compounds 2019-11-19
WO-2021099838-A1 Adenosine receptor antagonist compounds 2019-11-19
WO-2021076945-A1 Tropolone derivatives and tautomers thereof for iron regulation in animals 2019-10-16
WO-2021046315-A2 Inhibitors of encephalitic alphaviruses 2019-09-05
WO-2021007477-A1 Indazoles and azaindazoles as lrrk2 inhibitors 2019-07-11
CA-3145305-A1 Indazoles and azaindazoles as lrrk2 inhibitors 2019-07-11
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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