6-Morpholino-3-pyridineboronic Acid - CAS 904326-93-8

Catalog:	BB039856
Product Name:	6-Morpholino-3-pyridineboronic Acid
CAS:	904326-93-8
Synonyms:	[6-(4-morpholinyl)-3-pyridinyl]boronic acid; (6-morpholin-4-ylpyridin-3-yl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(6-morpholin-4-ylpyridin-3-yl)boronic acid
Description:	6-Morpholino-3-pyridineboronic Acid (CAS# 904326-93-8) is a useful research chemical.
Molecular Weight:	208.02
Molecular Formula:	C9H13N2O3B
Canonical SMILES:	B(C1=CN=C(C=C1)N2CCOCC2)(O)O
InChI:	InChI=1S/C9H13BN2O3/c13-10(14)8-1-2-9(11-7-8)12-3-5-15-6-4-12/h1-2,7,13-14H,3-6H2
InChI Key:	FFPQELNXDVTLEW-UHFFFAOYSA-N
Boiling Point:	458.6 °C at 760 mmHg
Density:	1.3 g/cm³
MDL:	MFCD03086116
LogP:	-1.33700

Publication Number	Title	Priority Date
WO-2021194326-A1	Aminopyrimidine derivatives and their use as aryl hydrocarbon receptor modulators	20200327
CN-113214288-A	Benzo [1,3] oxazine-oxazolidinone compound and preparation method and application thereof	20200204
WO-2021046315-A2	Inhibitors of encephalitic alphaviruses	20190905
WO-2020254572-A1	Egfr inhibitors for the treatment of cancer	20190621
US-2020361939-A1	Modulators of alpha-1 antitrypsin	20190514

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Related Functional Groups

Boronic Acids and Esters

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501
Signal Word:	Warning

Complexity:	200
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	208.1019224
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	208.1019224
Rotatable Bond Count:	2
Topological Polar Surface Area:	65.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0