2-(methylcarboxy)pyridine-5-boronic acid

Inquiry

Molecular Formula:

C7H8BNO4

Molecular Weight:

180.95

Product Information

Molecular Formula:

C7H8BNO4

Molecular Weight:

180.95

Description

2-(Methylcarboxy)pyridine-5-boronic Acid is a bio-active compound of considerable note within pharmaceutical exploration. Customarily harnessed as an integral reactant in drug development pursuits, particularly those seeking cancer remedies - with a fundamental focus on disrupting cell division in oncogenic entities.

Synonyms

6-(Methoxycarbonyl)pyridine-3-boronic acid; (6-(Methoxycarbonyl)pyridin-3-yl)boronic acid; (6-methoxycarbonylpyridin-3-yl)boronic acid; [6-(methoxycarbonyl)pyridin-3-yl]boronic acid; 2-(Methylcarboxy)pyridine-5-boronicacid; (6-methoxycarbonyl-3-pyridyl)boronic acid; 2-methoxycarbonylpyridine-5-boronic acid; 6-(methoxycarbonyl)pyridine-3-ylboronic acid; (6-(methoxycarbonyl)pyridin-3-yl)boronicacid; {6-[(methyloxy)carbonyl]-3-pyridinyl}boronic acid; 2-(methylcarboxy)pyridine-5-boronic acid; 6-(Methoxycarbonyl)pyridin-3-ylboronic acid, methyl 5-boronopyridine-2-carboxylate

IUPAC Name

(6-methoxycarbonylpyridin-3-yl)boronic acid

Canonical SMILES

B(C1=CN=C(C=C1)C(=O)OC)(O)O

InChI

InChI=1S/C7H8BNO4/c1-13-7(10)6-3-2-5(4-9-6)8(11)12/h2-4,11-12H,1H3

InChI Key

OJRWQJNSMWIFMD-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

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

181.0546379 g/mol

Monoisotopic Mass

181.0546379 g/mol

Topological Polar Surface Area

79.6Å²

Heavy Atom Count

Formal Charge

Complexity

187

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
US-2020361939-A1	Modulators of alpha-1 antitrypsin	2019-05-14
JP-2020128368-A	Medicine containing an azole-substituted pyridine compound as an active ingredient	2019-02-08
US-2020239476-A1	Gpr35 modulators	2019-01-24
WO-2020154492-A1	Gpr35 modulators	2019-01-24
AU-2020210930-A1	GPR35 modulators	2019-01-24
CA-3127786-A1	Gpr35 modulators	2019-01-24
IL-285074-D0	Gpr35 modulators	2019-01-24
KR-20210119485-A	GPR35 modulators	2019-01-24
US-11053251-B2	GPR35 modulators	2019-01-24
CN-113631168-A	GPR35 modulators	2019-01-24

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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