2-Fluoro-5-formylphenylboronic Acid - CAS 352534-79-3

Catalog:	BB022571
Product Name:	2-Fluoro-5-formylphenylboronic Acid
CAS:	352534-79-3
Synonyms:	(2-fluoro-5-formylphenyl)boronic acid; (2-fluoro-5-formylphenyl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(2-fluoro-5-formylphenyl)boronic acid
Description:	2-Fluoro-5-formylphenylboronic Acid (CAS# 352534-79-3) is a useful research chemical.
Molecular Weight:	167.93
Molecular Formula:	C7H6FO3B
Canonical SMILES:	B(C1=C(C=CC(=C1)C=O)F)(O)O
InChI:	InChI=1S/C7H6BFO3/c9-7-2-1-5(4-10)3-6(7)8(11)12/h1-4,11-12H
InChI Key:	SQSWYWCEKCVQEA-UHFFFAOYSA-N
Boiling Point:	360.2 °C at 760 mmHg
Density:	1.33 g/cm³
Appearance:	White powder
MDL:	MFCD03095100
LogP:	-0.68200

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Related Functional Groups

Boronic Acids and Esters

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2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
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[937796-06-0]
4-(3,5-Dimethyl-1-pyrazolyl)phenylboronic Acid Pinacol Ester
[850623-36-8]
Potassium (4-Cyanophenyl)trifluoroborate
[1450835-21-8]
(6-Chlorobenzo[b]thiophen-2-yl)boronic acid
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GHS Hazard Statement:	H302 (88.37%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (11.63%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (11.63%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (88.37%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (13.95%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	165
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	168.0394024
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	168.0394024
Rotatable Bond Count:	2
Topological Polar Surface Area:	57.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0