2-Phenoxybenzoic acid - CAS 2243-42-7

Name: 2-Phenoxybenzoic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB017611
Product Name:	2-Phenoxybenzoic acid
CAS:	2243-42-7
Synonyms:	2-phenoxybenzoic acid

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Computed Properties

IUPAC Name:	2-phenoxybenzoic acid
Description:	2-Phenoxybenzoic acid (CAS# 2243-42-7) is a useful research chemical.
Molecular Weight:	214.22
Molecular Formula:	C13H10O3
Canonical SMILES:	C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)O
InChI:	InChI=1S/C13H10O3/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10/h1-9H,(H,14,15)
InChI Key:	PKRSYEPBQPFNRB-UHFFFAOYSA-N
Boiling Point:	355 °C
Purity:	99 %
Density:	1.241 g/cm³
MDL:	MFCD00002429
LogP:	3.17710

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Related Functional Groups

Carbonyl Compounds

[87-88-7]C6H2Cl2O4
Chloranilic acid
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[17746-05-3]C11H21ClO
Undecanoyl chloride
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[253429-30-0]C12H16BrFO3
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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

Publication Number	Title	Priority Date
EP-3708565-A1	Pyrimidinyloxyphenylamidines and the use thereof as fungicides	20200304
WO-2021122608-A1	Low-molecular gelling agent as fragrant substance dispensing system	20191220
WO-2021122975-A1	Substituted thiophene carboxamides and derivatives thereof as microbicides	20191220
WO-2021122976-A1	Substituted thiophene carboxamides and derivatives thereof	20191220
WO-2021122986-A1	Thienyloxazolones and analogues	20191220

PMID	Publication Date	Title	Journal
21336645	20110901	Enzymes-based resistant mechanism in pyrethroid resistant and susceptible Aedes aegypti strains from northern Thailand	Parasitology research
19906501	20091201	[Comparison of the urinary excretion of biomarkers of exposure to pyrethroids and pyrethrins between residents of urban and rural areas of the province of Quebec, Canada]	Revue d'epidemiologie et de sante publique
21583863	20090418	5-(4-Phenoxy-phen-yl)-1,3,4-thia-diazol-2-amine	Acta crystallographica. Section E, Structure reports online
18752946	20080915	Discovery of novel series of benzoic acid derivatives containing biphenyl ether moiety as potent and selective human beta(3)-adrenergic receptor agonists: Part IV	Bioorganic & medicinal chemistry letters
17973501	20071201	Polyclonal antibody-based noncompetitive immunoassay for small analytes developed with short peptide loops isolated from phage libraries	Analytical chemistry

Complexity:	233
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.062994177
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	214.062994177
Rotatable Bond Count:	3
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1