4-Carboxy-3-fluorophenylboronic Acid - CAS 120153-08-4

Catalog:	BB004729
Product Name:	4-Carboxy-3-fluorophenylboronic Acid
CAS:	120153-08-4
Synonyms:	4-borono-2-fluorobenzoic acid; 4-borono-2-fluorobenzoic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	4-borono-2-fluorobenzoic acid
Description:	4-Carboxy-3-fluorophenylboronic Acid acts as a reagent in the discovery of novel azaindole-based series as potent AXL kinase inhibitors.
Molecular Weight:	183.93
Molecular Formula:	C7H6FO4B
Canonical SMILES:	B(C1=CC(=C(C=C1)C(=O)O)F)(O)O
InChI:	InChI=1S/C7H6BFO4/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3,12-13H,(H,10,11)
InChI Key:	CZDWJVSOQOMYGC-UHFFFAOYSA-N
Boiling Point:	399.5 °C at 760 mmHg
Density:	1.49 g/cm³
Storage:	Inert atmosphere, Room Temperature
MDL:	MFCD01114671
LogP:	-0.79630

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PMID	Publication Date	Title	Journal
15459093	20041201	Photonic crystal glucose-sensing material for noninvasive monitoring of glucose in tear fluid	Clinical chemistry

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Related Functional Groups

Boronic Acids and Esters

[766549-26-2]
2-Chloro-4-hydroxyphenylboronic Acid
[881302-73-4]
3,5-Dicarboxyphenylboronic Acid
[850623-36-8]
Potassium (4-Cyanophenyl)trifluoroborate
[1029439-85-7]
2,3-Difluoro-4-hydroxyphenylboronic Acid Pinacol Ester
[1171897-39-4]
5-(Boc-amino)pyridine-3-boronic Acid Pinacol Ester
[2247367-07-1]
4,4,4',4',5,5,5',5'-octaethyl-2,2'-bi(1,3,2-dioxaborolane)

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:	199
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.0343170
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	184.0343170
Rotatable Bond Count:	2
Topological Polar Surface Area:	77.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0