5-Methyl-3-pyridineboronic Acid - CAS 173999-18-3

Catalog:	BB012971
Product Name:	5-Methyl-3-pyridineboronic Acid
CAS:	173999-18-3
Synonyms:	(5-methyl-3-pyridinyl)boronic acid; (5-methylpyridin-3-yl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(5-methylpyridin-3-yl)boronic acid
Description:	5-Methyl-3-pyridineboronic Acid (CAS# 173999-18-3) is a useful research chemical.
Molecular Weight:	136.94
Molecular Formula:	C6H8NO2B
Canonical SMILES:	B(C1=CC(=CN=C1)C)(O)O
InChI:	InChI=1S/C6H8BNO2/c1-5-2-6(7(9)10)4-8-3-5/h2-4,9-10H,1H3
InChI Key:	REONQWGHSQHTAC-UHFFFAOYSA-N
Boiling Point:	331.9 °C at 760 mmHg
Flash Point:	Not applicable
Density:	1.18 g/cm³
MDL:	MFCD03428528
LogP:	-0.93020

Publication Number	Title	Priority Date
CN-112687878-A	Electrochemical device and electronic device	20201225
WO-2021178780-A1	Indazoles and azaindazoles as lrrk2 inhibitors	20200306
US-2021214366-A1	Bicyclic heterocycles as fgfr inhibitors	20200115
WO-2021146424-A1	Bicyclic heterocycles as fgfr inhibitors	20200115
WO-2021110574-A1	Alkynyl-(heteroaryl)-carboxamide hcn1 inhibitors	20191202

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Related Functional Groups

Boronic Acids and Esters

[1022092-33-6]
1-(2-Cyanoethyl)-1H-pyrazole-4-boronic Acid Pinacol Ester
[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[163105-90-6]
2-Methoxy-3-pyridylboronic Acid
[355836-10-1]
2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
[850623-36-8]
Potassium (4-Cyanophenyl)trifluoroborate
[1029439-85-7]
2,3-Difluoro-4-hydroxyphenylboronic Acid Pinacol Ester

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	110
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.0648087
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	137.0648087
Rotatable Bond Count:	1
Topological Polar Surface Area:	53.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0