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273-53-0,MFCD00005765
Catalog No.:AA0034FB

273-53-0 | Benzoxazole

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  • Technical Information
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Technical Information
Catalog Number:
AA0034FB
Chemical Name:
Benzoxazole
CAS Number:
273-53-0
Molecular Formula:
C7H5NO
Molecular Weight:
119.1207
MDL Number:
MFCD00005765
SMILES:
c1ccc2c(c1)ocn2
NSC Number:
3982
Properties
Properties
 
BP:
182.5°C at 760 mmHg  
Form:
Solid  
MP:
27-30 °C(lit.);  
Refractive Index:
1.5594  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
105  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
1.6  

Literature

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Title: On orthogonal and selective activation of glycosyl thioimidates and thioglycosides: application to oligosaccharide assembly.

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Title: Benzoxazole-based heterometallic dodecanuclear complex [Dy(III)4Cu(II)8] with single-molecule-magnet behavior.

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Title: Design, synthesis, and evaluation of orally active benzimidazoles and benzoxazoles as vascular endothelial growth factor-2 receptor tyrosine kinase inhibitors.

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Title: S-benzoxazolyl as a stable protecting moiety and a potent anomeric leaving group in oligosaccharide synthesis.

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Title: Design, synthesis, and in vitro evaluation of carbamate derivatives of 2-benzoxazolyl- and 2-benzothiazolyl-(3-hydroxyphenyl)-methanones as novel fatty acid amide hydrolase inhibitors.

Journal: Journal of medicinal chemistry 20070823

Title: Design and synthesis of highly potent and selective human peroxisome proliferator-activated receptor alpha agonists.

Journal: Bioorganic & medicinal chemistry letters 20070815

Title: Degenerate four-wave mixing in solution by cubic response theory and the polarizable continuum model.

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Title: Design of new benzoxazole-2-thione-derived inhibitors of Streptococcus pneumoniae hyaluronan lyase: structure of a complex with a 2-phenylindole.

Journal: Glycobiology 20060801

Title: Computational studies of nucleophilic attack and protonation of electron-deficient benzoheterocycle triosmium clusters.

Journal: Inorganic chemistry 20060626

Title: Synthesis, anti-inflammatory, analgesic and kinase (CDK-1, CDK-5 and GSK-3) inhibition activity evaluation of benzimidazole/benzoxazole derivatives and some Schiff's bases.

Journal: Bioorganic & medicinal chemistry 20060601

Title: Thermal reactions of benzoxazole. Single pulse shock tube experiments and quantum chemical calculations.

Journal: The journal of physical chemistry. A 20060406

Title: 3D-QSAR study on heterocyclic topoisomerase II inhibitors using CoMSIA.

Journal: SAR and QSAR in environmental research 20060401

Title: Parallel synthesis of a library of benzoxazoles and benzothiazoles using ligand-accelerated copper-catalyzed cyclizations of ortho-halobenzanilides.

Journal: The Journal of organic chemistry 20060303

Title: Synthesis and biological evaluation of novel heterocyclic quinones as inhibitors of the dual specificity protein phosphatase CDC25C.

Journal: Bioorganic & medicinal chemistry letters 20060101

Title: 3D-QSAR analysis on benzazole derivatives as eukaryotic topoisomerase II inhibitors by using comparative molecular field analysis method.

Journal: Bioorganic & medicinal chemistry 20051201

Title: Identification of the structural requirements of the receptor-binding affinity of diphenolic azoles to estrogen receptors alpha and beta by three-dimensional quantitative structure-activity relationship and structure-activity relationship analysis.

Journal: Journal of medicinal chemistry 20051201

Title: Differential solvation and tautomer stability of a model base pair within the minor and major grooves of DNA.

Journal: Journal of the American Chemical Society 20051109

Title: Orally active benzoxazole derivative as 5-HT3 receptor partial agonist for treatment of diarrhea-predominant irritable bowel syndrome.

Journal: Journal of medicinal chemistry 20051103

Title: Synthesis of some novel benzoxazole derivatives as anticancer, anti-HIV-1 and antimicrobial agents.

Journal: European journal of medicinal chemistry 20050901

Title: Deprotonation of benzoxazole and oxazole using lithium magnesates.

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Title: Anthryl-substituted heterocycles as acid-sensitive fluorescence probes.

Journal: The Journal of organic chemistry 20050513

Title: Synthesis and characterisation of the first transition metal complex of zoxazolamine (2-amino-5-chlorobenzoxazole): the X-ray crystal structure determination of [ZnCl2(eta 1-Nbenzoxazole-2-amino-5-chlorobenzoxazole)2].

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Title: Effects of positional and geometrical isomerism on the biological activity of some novel oxazolidinones.

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Title: Estrone formate: a novel type of irreversible inhibitor of human steroid sulfatase.

Journal: Bioorganic & medicinal chemistry letters 20041004

Title: Determination of serotonin, noradrenaline, dopamine and their metabolites in rat brain extracts and microdialysis samples by column liquid chromatography with fluorescence detection following derivatization with benzylamine and 1,2-diphenylethylenediamine.

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Title: Study on photochromic diarylethene with phenolic Schiff base: preparation and photochromism of diarylethene with benzoxazole.

Journal: The Journal of organic chemistry 20040723

Title: Synthesis and structure-activity relationship of novel benzoxazole derivatives as melatonin receptor agonists.

Journal: Bioorganic & medicinal chemistry letters 20040716

Title: Bioisosteric replacement of anilide with benzoxazole: potent and orally bioavailable antagonists of VLA-4.

Journal: Bioorganic & medicinal chemistry letters 20040503

Title: Syntheses and DNA-binding studies of a series of unsymmetrical cyanine dyes: structural influence on the degree of minor groove binding to natural DNA.

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Title: Some fused heterocyclic compounds as eukaryotic topoisomerase II inhibitors.

Journal: Biochemical and biophysical research communications 20040430

Title: Aminopyridine-benzoxanthene enantioselective receptor for sulfonylamino acids.

Journal: Organic letters 20040401

Title: Design and synthesis of benzoxazole derivatives as novel melatoninergic ligands.

Journal: Bioorganic & medicinal chemistry letters 20040308

Title: Vibrational analysis of structure activity relationships (SAR) in molecular binding.

Journal: Applied spectroscopy 20040301

Title: Emission ratiometric imaging of intracellular zinc: design of a benzoxazole fluorescent sensor and its application in two-photon microscopy.

Journal: Journal of the American Chemical Society 20040128

Title: Discovery of novel modulators of metabotropic glutamate receptor subtype-5.

Journal: Bioorganic & medicinal chemistry 20040102

Title: [Investigation of the trichinellocidal activity of the agents from a series of benzthiazole and benzoxazole].

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Title: A new approach to the synthesis of benzothiazole, benzoxazole, and pyridine nucleosides as potential antitumor agents.

Journal: Nucleosides, nucleotides & nucleic acids 20031101

Title: Cobalt-catalyzed arylation of azole heteroarenes via direct C-H bond functionalization.

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Title: Simultaneous determination of 5-hydroxyindoles and catechols by high-performance liquid chromatography with fluorescence detection following derivatization with benzylamine and 1,2-diphenylethylenediamine.

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Title: Design, synthesis and biological evaluation of benzimidazole/benzothiazole and benzoxazole derivatives as cyclooxygenase inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20030224

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Tags:273-53-0 Molecular Formula|273-53-0 MDL|273-53-0 SMILES|273-53-0 Benzoxazole