Catalog No.:AA003K8V

455-24-3 | 4-(Trifluoromethyl)benzoic acid

Name: Name:4-(Trifluoromethyl)benzoic acid
Brand: AABLOCKS
SKU: AA003K8V
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25g

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500g

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Technical Information
Properties
Upstream Synthesis Route
Downstream Synthesis Route
Literature
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Technical Information
Properties
Upstream Synthesis Route
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA003K8V

Chemical Name:

4-(Trifluoromethyl)benzoic acid

CAS Number:

455-24-3

Molecular Formula:

C8H5F3O2

Molecular Weight:

190.1193

MDL Number:

MFCD00002562

SMILES:

OC(=O)c1ccc(cc1)C(F)(F)F

NSC Number:

88327

Properties

BP:

243.2°C at 760 mmHg

Form:

Solid

MP:

219-220 °C(lit.)

Storage:

Keep in dry area;Room Temperature;

Computed Properties

Complexity:

192

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

3.1

Upstream Synthesis Route

455-24-3

402-49-3

[1]OrganicLetters,2012,vol.14,#18,p.4842-4845,4

[2]JournaloftheAmericanChemicalSociety,1983,vol.105,#5,p.1221-1227

[3]CanadianJournalofChemistry,1970,vol.48,p.125-132

[4]Synthesis(Germany),2013,vol.45,#23,p.3233-3238

7677-24-9

455-24-3

2338-75-2

[1]Synthesis(Germany),2013,vol.45,#23,p.3233-3238

455-24-3

2338-75-2

[1]CanadianJournalofChemistry,1970,vol.48,p.125-132

[2]HelveticaChimicaActa,1971,vol.54,p.868-897

74-96-4

455-24-3

329-15-7

711-33-1

[1]Patent:US4690931,1987,A,

455-24-3

320-94-5

[1]Patent:US2005/124681,2005,A1,.Locationinpatent:Page/Pagecolumn16

Downstream Synthesis Route

455-24-3

349-95-1

[1]AdvancedSynthesisandCatalysis,2016,vol.358,p.452-458

[2]TetrahedronLetters,2012,vol.53,p.5059-5063

[3]Science,2015,vol.350,p.298-302

[4]ChemicalScience,2019,vol.10,p.7433-7441

[5]ChemicalCommunications,2012,vol.48,p.10514-10516,3

[6]HelveticaChimicaActa,1971,vol.54,p.868-897

[7]JournaloftheAmericanChemicalSociety,1966,vol.88,p.5809-5816

[8]JournaloftheAmericanChemicalSociety,1983,vol.105,p.1221-1227

[9]CanadianJournalofChemistry,1970,vol.48,p.125-132

64-17-5

455-24-3

583-02-8

[1]JournaloftheAmericanChemicalSociety,1983,vol.105,p.1221-1227

[2]JournaloftheChemicalSociety.PerkintransactionsI,1997,p.2169-2174

[3]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2006,vol.45,p.483-488

[4]OrganicLetters,2015,vol.17,p.38-41

[5]Chemistry-AEuropeanJournal,2016,vol.22,p.211-221

[6]BioorganicChemistry,2016,vol.65,p.126-136

[7]Phosphorus,SulfurandSiliconandtheRelatedElements,2017,vol.192,p.1259-1263

[8]RSCAdvances,2018,vol.8,p.6306-6314

124-38-9

146397-87-7

402-45-9

455-24-3

[1]JournaloftheChemicalSociety.Chemicalcommunications,1992,p.1729-1730

[2]EuropeanJournalofOrganicChemistry,1998,p.1811-1821

455-24-3

320-94-5

116965-16-3

[1]LiebigsAnnalenderChemie,1990,p.569-579

455-24-3

108-24-7

583-02-8

[1]JournaloftheChemicalSociety.PerkintransactionsII,1981,p.753-759

Literature

Title: Antifungal Activity of Salicylanilides and Their Esters with 4-(Trifluoromethyl)benzoic Acid.

Journal: Molecules (Basel, Switzerland) 20120807

Title: High resolution magic angle spinning NMR to investigate ligand-receptor binding events for mass-limited samples in liquids.

Journal: Journal of pharmaceutical and biomedical analysis 20120205

Title: Development of ST-246® for Treatment of Poxvirus Infections.

Journal: Viruses 20101101

Title: Coordination-Polymeric Nanofibers and their Field-Emission Properties.

Journal: Macromolecular rapid communications 20090803

Title: Triphenyl-bis[4-(trifluoro-meth-yl)benzoato-κO]anti-mony(V).

Journal: Acta crystallographica. Section E, Structure reports online 20090601

Title: Total synthesis of the C-1027 chromophore core: extremely facile enediyne formation through Sml2-mediated 1,2-elimination.

Journal: Angewandte Chemie (International ed. in English) 20080101

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