Benzofuran-6-boronic Acid - CAS 851525-10-5

Name: Benzofuran-6-boronic Acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB037512
Product Name:	Benzofuran-6-boronic Acid
CAS:	851525-10-5
Synonyms:	6-benzofuranylboronic acid; 1-benzofuran-6-ylboronic acid

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Computed Properties

IUPAC Name:	1-benzofuran-6-ylboronic acid
Description:	Benzofuran-6-boronic Acid (CAS# 851525-10-5) is a useful research chemical.
Molecular Weight:	161.95
Molecular Formula:	C8H7O3B
Canonical SMILES:	B(C1=CC2=C(C=C1)C=CO2)(O)O
InChI:	InChI=1S/C8H7BO3/c10-9(11)7-2-1-6-3-4-12-8(6)5-7/h1-5,10-11H
InChI Key:	IBCSNLAKMCMGCZ-UHFFFAOYSA-N
LogP:	0.11260

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Related Functional Groups

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[10365-98-7]C7H9BO3
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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

Publication Number	Title	Priority Date
CA-3014432-A1	Substituted 4-benzyl and 4-benzoyl piperidine derivatives	20150618
EP-3310773-A1	Substituted 4-benzyl and 4-benzoyl piperidine derivatives	20150618
JP-2018524318-A	Substituted 4-benzyl and 4-benzoylpiperidine derivatives	20150618
US-2020031797-A1	Substituted 4-benzyl and 4-benzoyl piperidine derivatives	20150618
WO-2016205590-A1	Substituted 4-benzyl and 4-benzoyl piperidine derivatives	20150618

Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.0488242
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	162.0488242
Rotatable Bond Count:	1
Topological Polar Surface Area:	53.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0