4-Methoxypyridine-3-boronic Acid - CAS 355004-67-0

Catalog:	BB022659
Product Name:	4-Methoxypyridine-3-boronic Acid
CAS:	355004-67-0
Synonyms:	(4-methoxy-3-pyridinyl)boronic acid; (4-methoxypyridin-3-yl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(4-methoxypyridin-3-yl)boronic acid
Description:	4-Methoxypyridine-3-boronic Acid (CAS# 355004-67-0) is a useful research chemical.
Molecular Weight:	152.94
Molecular Formula:	C6H8NO3B
Canonical SMILES:	B(C1=C(C=CN=C1)OC)(O)O
InChI:	InChI=1S/C6H8BNO3/c1-11-6-2-3-8-4-5(6)7(9)10/h2-4,9-10H,1H3
InChI Key:	YUTPAZKVEOJQCY-UHFFFAOYSA-N
Boiling Point:	357 °C at 760 mmHg
Density:	1.24 g/cm³
Appearance:	Cream powder
MDL:	MFCD01114676
LogP:	-1.23000

Publication Number	Title	Priority Date
WO-2020251974-A1	Smarca inhibitors and uses thereof	20190610
WO-2020243459-A1	Thiadiazolyl derivatives as dna polymerase theta inhibitors	20190531
WO-2020191261-A1	Indazoles as lrrk2 inhibitors	20190321
WO-2020069402-A1	Cinnoline compounds and for the treatment of hpk1-dependent disorders such as cancer	20180930
EP-3856724-A1	Cinnoline compounds and for the treatment of hpk1-dependent disorders such as cancer	20180930

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Related Functional Groups

Boronic Acids and Esters

[1022092-33-6]
1-(2-Cyanoethyl)-1H-pyrazole-4-boronic Acid Pinacol Ester
[1219956-23-6]
2,4-Diphenyl-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine
[766549-26-2]
2-Chloro-4-hydroxyphenylboronic Acid
[871126-22-6]
2-Fluoro-4-formylphenylboronic acid
[380430-53-5]
2-Ethoxycarbonylphenylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.0597233
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	153.0597233
Rotatable Bond Count:	2
Topological Polar Surface Area:	62.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0