2-(Hydroxymethyl)phenylboronic Acid - CAS 87199-14-2

Catalog:	BB038326
Product Name:	2-(Hydroxymethyl)phenylboronic Acid
CAS:	87199-14-2
Synonyms:	[2-(hydroxymethyl)phenyl]boronic acid; [2-(hydroxymethyl)phenyl]boronic acid

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Computed Properties

IUPAC Name:	[2-(hydroxymethyl)phenyl]boronic acid
Description:	2-(Hydroxymethyl)phenylboronic Acid (CAS# 87199-14-2) is a useful research chemical.
Molecular Weight:	151.96
Molecular Formula:	C7H9O3B
Canonical SMILES:	B(C1=CC=CC=C1CO)(O)O
InChI:	InChI=1S/C7H9BO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4,9-11H,5H2
InChI Key:	AFHOBSCDNXGFMO-UHFFFAOYSA-N
Boiling Point:	379.8 °C at 760 mmHg
Density:	1.25 g/cm³
MDL:	MFCD01075677
LogP:	-1.14130

Publication Number	Title	Priority Date
CN-113136023-A	Preparation method of porous aromatic skeleton containing hydroxymethyl, and functional material and application thereof	20210425
CN-112255899-A	Water-based PI film stripping liquid and preparation method thereof	20201124
EP-3878891-A1	Dynamic covalent hydrogels, precursors thereof and uses thereof	20200310
WO-2021180795-A1	Dynamic covalent hydrogels, precursors thereof and uses thereof	20200310
CN-111377968-A	Aryl-containing boronic acids99mTc (III) complex, its kit formula and application	20200309

PMID	Publication Date	Title	Journal
20710065	20100811	Phenylboronic-acid-based carbohydrate binders as antiviral therapeutics: monophenylboronic acids	Antiviral chemistry & chemotherapy
20337440	20100422	A solid-state (11)b NMR and computational study of boron electric field gradient and chemical shift tensors in boronic acids and boronic esters	The journal of physical chemistry. A
18549270	20080905	Benzoboroxoles as efficient glycopyranoside-binding agents in physiological conditions: structure and selectivity of complex formation	The Journal of organic chemistry
16568987	20060405	An improved class of sugar-binding boronic acids, soluble and capable of complexing glycosides in neutral water	Journal of the American Chemical Society

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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:	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:	3
Isotope Atom Count:	0
Monoisotopic Mass:	152.0644743
Rotatable Bond Count:	2
Topological Polar Surface Area:	60.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0