2,3-Dihydrobenzofuran-5-boronic Acid - CAS 227305-69-3

Catalog:	BB017727
Product Name:	2,3-Dihydrobenzofuran-5-boronic Acid
CAS:	227305-69-3
Synonyms:	2,3-dihydrobenzofuran-5-ylboronic acid; 2,3-dihydro-1-benzofuran-5-ylboronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2,3-dihydro-1-benzofuran-5-ylboronic acid
Description:	2,3-Dihydrobenzofuran-5-boronic Acid (CAS# 227305-69-3) is a useful research chemical.
Molecular Weight:	163.97
Molecular Formula:	C8H9O3B
Canonical SMILES:	B(C1=CC2=C(C=C1)OCC2)(O)O
InChI:	InChI=1S/C8H9BO3/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-2,5,10-11H,3-4H2
InChI Key:	ZIXLJHSFAMVHPC-UHFFFAOYSA-N
Boiling Point:	358.4 °C at 760 mmHg
Density:	1.29 g/cm³
Solubility:	Slightly Soluble in water(2.6 g/L) (25°C)
Appearance:	White solid
LogP:	-0.69870

Publication Number	Title	Priority Date
WO-2021161047-A1	Usp7 inhibitor for use in the treatment of cancer	20200213
WO-2021074281-A1	Substituted azacyles as trmp8 modulators	20191017
US-2020131172-A1	Dynamin-1-like protein inhibitors	20170426
WO-2018200674-A1	Dynamin-1-like protein inhibitors	20170426
AU-2017346453-A1	Pharmaceutical compounds	20161018

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Related Functional Groups

Boronic Acids and Esters

[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[1219956-23-6]
2,4-Diphenyl-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine
[163105-90-6]
2-Methoxy-3-pyridylboronic Acid
[937796-06-0]
4-(3,5-Dimethyl-1-pyrazolyl)phenylboronic Acid Pinacol Ester
[1245906-70-0]
Potassium (2-Chloro-5-pyrimidinyl)trifluoroborate

GHS Hazard Statement:	H302 (33.33%): 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:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	164.0644743
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	164.0644743
Rotatable Bond Count:	1
Topological Polar Surface Area:	49.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0