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553-86-6,MFCD00005856
Catalog No.:AA00I9SG

553-86-6 | 3H-Benzofuran-2-one

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10g
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$6.00   $4.00
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25g
98%
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$13.00   $9.00
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100g
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$48.00   $34.00
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500g
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  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00I9SG
Chemical Name:
3H-Benzofuran-2-one
CAS Number:
553-86-6
Molecular Formula:
C8H6O2
Molecular Weight:
134.1320
MDL Number:
MFCD00005856
SMILES:
O=C1Cc2c(O1)cccc2
NSC Number:
227414
Properties
Computed Properties
 
Complexity:
153  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
1.3  

Literature

Title: Agropyrenol and agropyrenal, phytotoxins from Ascochyta agropyrina var. nana, a fungal pathogen of Elitrigia repens.

Journal: Phytochemistry 20120701

Title: Asymmetric Michael addition reactions of 3-substituted benzofuran-2(3H)-ones to nitroolefins catalyzed by a bifunctional tertiary-amine thiourea.

Journal: Organic & biomolecular chemistry 20120114

Title: Identification of phenylalkane derivatives when Mycobacterium neoaurum and Rhodococcus erythropolis were cultured in the presence of various phenylalkanes.

Journal: Applied microbiology and biotechnology 20120101

Title: Histone deacetylase inhibitors in cell pluripotency, differentiation, and reprogramming.

Journal: Stem cells international 20120101

Title: (Z)-2-(4-Nitro-benzyl-idene)-1-benzofuran-3(2H)-one.

Journal: Acta crystallographica. Section E, Structure reports online 20111101

Title: Efficient synthesis of benzofuranones: N-heterocyclic carbene (NHC)/base-catalyzed hydroacylation-Stetter-rearrangement cascade.

Journal: Organic letters 20111021

Title: Pharmacological characterization of histone deacetylase inhibitor and tumor cell-growth inhibition properties of new benzofuranone compounds.

Journal: Current cancer drug targets 20111001

Title: Benzofuranone derivatives as effective small molecules related to insulin amyloid fibrillation: a structure-function study.

Journal: Chemical biology & drug design 20111001

Title: Synthesis and structure-activity relationships of constrained heterocyclic analogues of combretastatin A4.

Journal: ChemMedChem 20110905

Title: Synthesis of γ-benzopyranone by TfOH-promoted regioselective cyclization of o-alkynoylphenols.

Journal: Organic letters 20110902

Title: Second generation benzofuranone ring substituted noscapine analogs: synthesis and biological evaluation.

Journal: Biochemical pharmacology 20110715

Title: Chiral biscinchona alkaloid promoted asymmetric allylic alkylation of 3-substituted benzofuran-2(3H)-ones with Morita-Baylis-Hillman carbonates.

Journal: The Journal of organic chemistry 20110715

Title: (Z)-2-(2-Hy-droxy-4-meth-oxy-benzyl-idene)-1-benzofuran-3(2H)-one.

Journal: Acta crystallographica. Section E, Structure reports online 20110601

Title: New cytotoxic metabolites from a deep-sea-derived fungus, Phialocephala sp., strain FL30r.

Journal: Chemistry & biodiversity 20110501

Title: 7-(tert-Butyl-diphenyl-sil-yloxy)-2,2-dimethyl-1-benzofuran-3(2H)-one.

Journal: Acta crystallographica. Section E, Structure reports online 20110201

Title: Ethyl 2-(2-hy-droxy-5-nitro-phen-yl)acetate.

Journal: Acta crystallographica. Section E, Structure reports online 20110201

Title: Chiral amine thiourea-promoted enantioselective Michael addition reactions of 3-substituted benzofuran-2(3H)-ones to maleimides.

Journal: The Journal of organic chemistry 20101217

Title: 5-ureidobenzofuranone indoles as potent and efficacious inhibitors of PI3 kinase-alpha and mTOR for the treatment of breast cancer.

Journal: Bioorganic & medicinal chemistry letters 20100615

Title: 4-Substituted-7-azaindoles bearing a ureidobenzofuranone moiety as potent and selective, ATP-competitive inhibitors of the mammalian target of rapamycin (mTOR).

Journal: Bioorganic & medicinal chemistry letters 20100401

Title: Effect of bridgehead substitution on the fluorescence quenching of 2,3-diazabicyclo[2.2.2]oct-2-enes by solvents and antioxidants.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20091201

Title: Antinociceptive activity of a new benzofuranone derived from a chalcone.

Journal: Basic & clinical pharmacology & toxicology 20091001

Title: Relationships between paraoxon and 2-coumaranone hydrolytic activities in sera genotyped for PON1 Q192R polymorphism.

Journal: Clinical biochemistry 20091001

Title: Synthesis and modeling of new benzofuranone histone deacetylase inhibitors that stimulate tumor suppressor gene expression.

Journal: Journal of medicinal chemistry 20090514

Title: Incarviditone: a novel cytotoxic benzofuranone dimer from Incarvillea delavayi Bureau et Franchet.

Journal: Chemistry & biodiversity 20090501

Title: Synthesis, binding affinity, and molecular docking analysis of new benzofuranone derivatives as potential antipsychotics.

Journal: Journal of medicinal chemistry 20081009

Title: [Isolation and identification of toxins inhibiting Dentrolimus tabulaeformis from an antagonistic strain of Beauveria].

Journal: Wei sheng wu xue bao = Acta microbiologica Sinica 20080501

Title: A new benzofuranone and anti-HIV constituents from the stems of Rhus chinensis.

Journal: Planta medica 20070301

Title: Ab initio and DFT studies of the vibrational spectra of benzofuran and some of its derivatives.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20061201

Title: Approaches to the quaternary stereocentre and to the heterocyclic core in diazonamide A using the Heck reaction and related coupling reactions.

Journal: Organic & biomolecular chemistry 20061121

Title: Kinetics of proton transfer from benzo[b]-2,3-dihydrofuran-2-one and benzo[b]-2,3-dihydrothiophene-2-one. Effect of anion aromaticity on intrinsic barriers.

Journal: The Journal of organic chemistry 20061013

Title: The diazo route to diazonamide A: studies on the tyrosine-derived fragment.

Journal: Organic & biomolecular chemistry 20051021

Title: Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.

Journal: Journal of medicinal chemistry 20050602

Title: Biosynthesis of benzofuran derivatives in root cultures of Tagetes patula via phenylalanine and 1-deoxy-D-xylulose 5-phosphate.

Journal: Phytochemistry 20050401

Title: Inhibitors of Sir2: evaluation of splitomicin analogues.

Journal: Journal of medicinal chemistry 20040506

Title: Photoreactions of 3-diazo-3H-benzofuran-2-one; dimerization and hydrolysis of its primary photoproduct, a quinonoid cumulenone: a study by time-resolved optical and infrared spectroscopy.

Journal: Journal of the American Chemical Society 20031022

Title: Vibrational spectra of 2 (3H) benzofuranone studied by Raman, IR spectroscopy and AM1 semiempirical molecular orbital calculations.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20030115

Title: Comparison of oxygen and sulfur effects on keto-enol chemistry in benzolactone systems: benzo[b]-2,3-dihydrofuran-2-one and -2-thione and benzo[b]-2,3-dihydrothiophene-2-one and -2-thione.

Journal: Journal of the American Chemical Society 20020807

Title: Flavonoid oxidation by the radical generator AIBN: a unified mechanism for quercetin radical scavenging.

Journal: Journal of agricultural and food chemistry 20020717

Title: New serotonin 5-HT(2A), 5-HT(2B), and 5-HT(2C) receptor antagonists: synthesis, pharmacology, 3D-QSAR, and molecular modeling of (aminoalkyl)benzo and heterocycloalkanones.

Journal: Journal of medicinal chemistry 20020103

Title: Lactone-derived carbon-centered radicals: formation and reactivity with oxygen.

Journal: Organic letters 20011213

Title: Benzo[b]thiophene desulfurization by Gordonia rubropertinctus strain T08.

Journal: Applied microbiology and biotechnology 20011001

Title: Cytotoxic activity of 2-aminomethylene-3(2H)-benzofuranones against human oral tumor cell lines.

Journal: Anticancer research 20010101

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