4-Methoxypyrimidine-5-boronic Acid - CAS 909187-37-7

Catalog:	BB039988
Product Name:	4-Methoxypyrimidine-5-boronic Acid
CAS:	909187-37-7
Synonyms:	(4-methoxy-5-pyrimidinyl)boronic acid; (4-methoxypyrimidin-5-yl)boronic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	(4-methoxypyrimidin-5-yl)boronic acid
Description:	4-Methoxypyrimidine-5-boronic Acid (CAS# 909187-37-7) is potentially useful in Suzuki-Miyaura cross-coupling reaction for the palladium catalyzed formation of carbon-carbon bonds.
Molecular Weight:	153.93
Molecular Formula:	C5H7N2O3B
Canonical SMILES:	B(C1=CN=CN=C1OC)(O)O
InChI:	InChI=1S/C5H7BN2O3/c1-11-5-4(6(9)10)2-7-3-8-5/h2-3,9-10H,1H3
InChI Key:	SIHFIKAJVVQLMX-UHFFFAOYSA-N
LogP:	-1.83500

Publication Number	Title	Priority Date
AU-2017378324-A1	Bycyclic heteroaryl derivatives as CFTR potentiators	20161216
CA-3046968-A1	Bycyclic heteroaryl derivatives as cftr potentiators	20161216
CN-110300589-A	Bicyclic different heteroaryl derivative as CFTR synergist	20161216
EP-3554506-A1	Bycyclic heteroaryl derivatives as cftr potentiators	20161216
JP-2020502103-A	Bicyclic heteroaryl derivatives as CFTR enhancers	20161216

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Related Functional Groups

Boronic Acids and Esters

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3,5-Dicarboxyphenylboronic Acid
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3-Methoxybenzeneboronic Acid
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Potassium (2-Chloro-5-pyrimidinyl)trifluoroborate

Complexity:	124
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.0549723
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	154.0549723
Rotatable Bond Count:	2
Topological Polar Surface Area:	75.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0