Catalog No.:AA00I6QO

345-16-4 | 5-Fluorosalicylic acid

Name: Name:5-Fluorosalicylic acid
Brand: AABLOCKS
SKU: AA00I6QO
Availability: InStock
Rating: 90 (10 reviews)

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in stock

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98%

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10g

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25g

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100g

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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:

AA00I6QO

Chemical Name:

5-Fluorosalicylic acid

CAS Number:

345-16-4

Molecular Formula:

C7H5FO3

Molecular Weight:

156.1112

MDL Number:

MFCD00002456

SMILES:

Fc1ccc(c(c1)C(=O)O)O

NSC Number:

46619

Properties

BP:

307.4°C at 760 mmHg

Form:

Solid

MP:

177-179 °C(lit.)

Storage:

Inert atmosphere;Room Temperature;

Computed Properties

Complexity:

160

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

2.6

Upstream Synthesis Route

67-56-1

345-16-4

391-92-4

[1]Patent:EP2813495,2014,A1,.Locationinpatent:Paragraph0016

[2]Patent:US2015/18542,2015,A1,.Locationinpatent:Paragraph0063;0064;0065

[3]JournalofMedicinalChemistry,2014,vol.57,#13,p.5579-5601

[4]Patent:WO2016/96686,2016,A1,.Locationinpatent:Page/Pagecolumn83

[5]Patent:WO2017/211759,2017,A1,.Locationinpatent:Page/Pagecolumn46

[6]Patent:WO2013/132376,2013,A1,.Locationinpatent:Page/Pagecolumn181

[7]JournalofMedicinalChemistry,2014,vol.57,#11,p.4720-4744

[8]JournalofMedicinalChemistry,1992,vol.35,#2,p.310-319

[9]Patent:WO2006/46916,2006,A1,.Locationinpatent:Page/Pagecolumn55

[10]Patent:US2014/275172,2014,A1,.Locationinpatent:Paragraph0400

67-56-1

345-16-4

149-73-5

391-92-4

[1]Patent:US2006/63926,2006,A1,.Locationinpatent:Page/Pagecolumn5;8

345-16-4

74-88-4

391-92-4

[1]OrganicLetters,2018,vol.20,#5,p.1316-1319

345-16-4

75-36-5

391-92-4

[1]Patent:WO2011/151651,2011,A1,.Locationinpatent:Page/Pagecolumn60

455-38-9

345-16-4

[1]Synlett,2016,vol.27,#2,p.277-281

Downstream Synthesis Route

394-04-7

345-16-4

[1]JournalofOrganicChemistry,1954,vol.19,p.1617,1621 BulletindelaSocieteChimiquedeFrance,1956,p.629,632

[2]Bulletindel'AcademiePolonaisedesSciences,SeriedesSciencesChimiques,1960,vol.8,p.591-597

345-16-4

108-24-7

448-40-8

[1]Patent:WO2015/44177,2015,A1.Locationinpatent:Page/Pagecolumn28

[2]BioorganicandMedicinalChemistry,2011,vol.19,p.2030-2045

[3]DaltonTransactions,2019,vol.48,p.15856-15868

[4]JournaloftheAmericanChemicalSociety,1939,vol.61,p.2317

[5]JournalofMedicinalChemistry,1997,vol.40,p.1075-1089

[6]Patent:CN105294732,2016,A.Locationinpatent:Paragraph1406

[7]Patent:JP2015/155430,2015,A.Locationinpatent:Paragraph0103

67-56-1

345-16-4

391-92-4

[1]Patent:EP2813495,2014,A1.Locationinpatent:Paragraph0016

[2]Patent:US2015/18542,2015,A1.Locationinpatent:Paragraph0063;0064;0065

[3]JournalofMedicinalChemistry,2014,vol.57,p.5579-5601

[4]Patent:WO2016/96686,2016,A1.Locationinpatent:Page/Pagecolumn83

[5]Patent:WO2017/211759,2017,A1.Locationinpatent:Page/Pagecolumn46

[6]Patent:WO2013/132376,2013,A1.Locationinpatent:Page/Pagecolumn181

[7]JournalofMedicinalChemistry,2014,vol.57,p.4720-4744

[8]JournalofMedicinalChemistry,1992,vol.35,p.310-319

[9]Patent:WO2006/46916,2006,A1.Locationinpatent:Page/Pagecolumn55

[10]Patent:US2014/275172,2014,A1.Locationinpatent:Paragraph0400

[11]Patent:US2018/346438,2018,A1.Locationinpatent:Paragraph0184-0186

345-16-4

77-78-1

151793-20-3

[1]Corona,LDel;Signorelli,G;Pinzetta,A;Coppi,G[EuropeanJournalofMedicinalChemistry,1993,vol.28,#5,p.419-425]

345-16-4

583-75-5

77068-04-3

[1]ChemicalandPharmaceuticalBulletin,1984,vol.32,p.305-312

Literature

Title: Fluorescence-based high-throughput screening assay for drug interactions with UGT1A6.

Journal: Assay and drug development technologies 20111001

Title: Cα-C bond cleavage of the peptide backbone in MALDI in-source decay using salicylic acid derivative matrices.

Journal: Journal of the American Society for Mass Spectrometry 20110701

Title: Exploring single and double proton transfer processes in the gas phase: a high resolution electronic spectroscopy study of 5-fluorosalicylic acid.

Journal: The Journal of chemical physics 20110227

Title: Identifying chelators for metalloprotein inhibitors using a fragment-based approach.

Journal: Journal of medicinal chemistry 20110127

Title: Effect of fluorine position on the coordinating ability of fluorosalicylic acids--an experimental study complemented with computations.

Journal: Journal of inorganic biochemistry 20110101

Title: Diaqua-bis(5-fluoro-2-hydroxy-benzoato-κO)zinc(II).

Journal: Acta crystallographica. Section E, Structure reports online 20090301

Title: Complexation of 5-fluorosalicylic acid with copper(II): a pH-potentiometric, UV-vis spectroscopic, and electron spin resonance study by the two-dimensional simulation of spectra.

Journal: Journal of inorganic biochemistry 20080101

Title: Mono- and disalicylic acid derivatives: PTP1B inhibitors as potential anti-obesity drugs.

Journal: Bioorganic & medicinal chemistry 20071015

Title: Salicylate activity. 3. Structure relationship to systemic acquired resistance.

Journal: Journal of agricultural and food chemistry 20051214

Title: Quantification of free and total salicylic acid in plants by solid-phase extraction and isocratic high-performance anion-exchange chromatography.

Journal: Analytical and bioanalytical chemistry 20050801

Title: [Enzyme-amplified time-resolved fluorescence detection for nucleic acid hybridization assays].

Journal: Zhongguo yi xue ke xue yuan xue bao. Acta Academiae Medicinae Sinicae 20020201

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