3-Methoxy-4-pyridineboronic acid pinacol ester

Product Information

Molecular Formula:
C12H18BNO3
Molecular Weight:
235.09
Description
3-Methoxy-4-pyridineboronic acid pinacol ester is a powerful medicinal compound used in the biomedical industry. By targeting specific molecular pathways, this product shows promising efficacy in inhibiting tumor growth and reducing inflammation, making it a valuable asset in drug development and disease research.
Synonyms
3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 3-METHOXY-4-PYRIDINEBORONIC ACID PINACOL ESTER; 3-METHOXYPYRIDIN-4-YLBORONIC ACID PINACOL ESTER; Pyridine, 3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-; 3-METHOXY-4-(TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDINE; 3-Methoxy-4-pyridineboronicacidpinacolester; 3-Methoxy-4-pyridineboronic acid pinacol ester, 97%
IUPAC Name
3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C=NC=C2)OC
InChI
InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-7-14-8-10(9)15-5/h6-8H,1-5H3
InChI Key
HLRJDJZOIOTKSF-UHFFFAOYSA-N
Melting Point
146 °C
Flash Point
Not applicable
Purity
97%
Storage
−20°C

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
235.1379736 g/mol
Monoisotopic Mass
235.1379736 g/mol
Topological Polar Surface Area
40.6Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
267
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-110015987-B Preparation method of 2,3 '-dimethoxy- [2,4' ] bipyridyl 2019-05-22
CN-111511742-A Pyrazolo [3,4-b ] pyridines and imidazo [1,5-b ] pyridazines as PDE1 inhibitors 2017-12-20
US-2021009571-A1 Pyrazolo[3,4-b]pyridines and imidazo[1,5-b]pyridazines as pde1 inhibitors 2017-12-20
JP-2018145180-A A pharmaceutical comprising a biaryl derivative or a salt thereof 2017-03-01
JP-2019073537-A Drug comprising a biaryl derivative or a salt thereof 2017-03-01
JP-6469272-B2 A pharmaceutical comprising a biaryl derivative or a salt thereof 2017-03-01
US-10654834-B2 Non-systemic TGR5 agonists 2016-07-01
US-2019330191-A1 Novel non-systemic tgr5 agonists 2016-07-01
US-2020308122-A1 Novel non-systemic tgr5 agonists 2016-07-01
US-11236055-B2 Non-systemic TGR5 agonists 2016-07-01
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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