2-Methoxybenzeneboronic Acid - CAS 5720-06-9

Catalog:	BB029609
Product Name:	2-Methoxybenzeneboronic Acid
CAS:	5720-06-9
Synonyms:	(2-methoxyphenyl)boronic acid; (2-methoxyphenyl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(2-methoxyphenyl)boronic acid
Description:	2-Methoxybenzeneboronic Acid (CAS# 5720-06-9) is a phenylboronic acid used to investigate boron function in plants.
Molecular Weight:	151.96
Molecular Formula:	C7H9O3B
Canonical SMILES:	B(C1=CC=CC=C1OC)(O)O
InChI:	InChI=1S/C7H9BO3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5,9-10H,1H3
InChI Key:	ROEQGIFOWRQYHD-UHFFFAOYSA-N
Boiling Point:	319.3 °C at 760 mmHg
Melting Point:	105-110 °C (lit.)
Flash Point:	Not applicable
Purity:	95 %
Density:	1.17 g/cm³
MDL:	MFCD00236047
LogP:	-0.62500

Publication Number	Title	Priority Date
CN-113150005-A	Quinoxaline compound, preparation method and application thereof in medicine	20210409
CN-113045597-A	Visible light driven boron-doped thick photochromic material and preparation and application thereof	20210325
CN-113004194-A	Circular polarization luminescent organic micro-nano crystal material and preparation method and application thereof	20210309
CN-112851671-A	4-substituted pyrido [2,3-d ] pyrimidine-7-ketone compound and preparation method and application thereof	20210208
CN-112939971-A	Coumarin compound and preparation method and application thereof	20210208

PMID	Publication Date	Title	Journal
18983140	20081127	Discovery of boronic acids as novel and potent inhibitors of fatty acid amide hydrolase	Journal of medicinal chemistry

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Related Functional Groups

Boronic Acids and Esters

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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
[163105-90-6]
2-Methoxy-3-pyridylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester
[1450835-21-8]
(6-Chlorobenzo[b]thiophen-2-yl)boronic acid

GHS Hazard Statement:	H302 (16.67%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	118
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	152.0644743
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	152.0644743
Rotatable Bond Count:	2
Topological Polar Surface Area:	49.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0