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5466-88-6,MFCD00158536
Catalog No.:AA003HA1

5466-88-6 | 2H-1,4-Benzoxazin-3(4H)-one

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5g
95%
in stock  
$14.00   $10.00
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25g
95%
in stock  
$33.00   $23.00
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100g
98%
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$125.00   $88.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HA1
Chemical Name:
2H-1,4-Benzoxazin-3(4H)-one
CAS Number:
5466-88-6
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
MDL Number:
MFCD00158536
SMILES:
O=C1COc2c(N1)cccc2
NSC Number:
26354
Properties
Properties
 
BP:
337.7°C at 760 mmHg  
Form:
Solid  
MP:
172-176 °C  
Solubility:
methanol: soluble25mg/mL, clear, colorless  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
170  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
0.9  

Literature

Title: In silico characterization of three two-component systems of Ehrlichia canis and evaluation of a natural plant-derived inhibitor.

Journal: Genetics and molecular research : GMR 20121004

Title: Synthesis of 2H-benzo[b][1,4]oxazin-3(4H)-one derivatives as platelet aggregation inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20120101

Title: Synthesis and pharmacological evaluations of novel 2H-benzo[b][1,4]oxazin-3(4H)-one derivatives as a new class of anti-cancer agents.

Journal: European journal of medicinal chemistry 20111001

Title: Structure-activity relationship of benzoxazinones and related compounds with respect to the growth inhibition and alpha-amylase activity in cress seedlings.

Journal: Journal of plant physiology 20101015

Title: Fluconazole analogues containing 2H-1,4-benzothiazin-3(4H)-one or 2H-1,4-benzoxazin-3(4H)-one moieties, a novel class of anti-Candida agents.

Journal: Bioorganic & medicinal chemistry letters 20100115

Title: Aromatic-ring-functionalised benzoxazinones in the system Oryza sativa-Echinochloa crus-galli as biorational herbicide models.

Journal: Pest management science 20091001

Title: Rediscovering the bioactivity and ecological role of 1,4-benzoxazinones.

Journal: Natural product reports 20090401

Title: Synthesis of novel 1,4-benzoxazin-3-one derivatives as inhibitors against tyrosine kinases.

Journal: Bioorganic & medicinal chemistry 20090115

Title: Synthesis of novel 7-benzylamino-2H-1,4-benzoxazin-3(4H)-ones as anticonvulsant agents.

Journal: European journal of medicinal chemistry 20080601

Title: Novel potent and selective thrombin inhibitors based on a central 1,4-benzoxazin-3(4H)-one scaffold.

Journal: Journal of medicinal chemistry 20080508

Title: Study on bioactive compounds from Streptomyces sp. ANU 6277.

Journal: Polish journal of microbiology 20080101

Title: Bad housekeeping: why do aphids leave their exuviae inside the colony?

Journal: BMC evolutionary biology 20080101

Title: Benzofused tricycles based on 2-quinoxalinol.

Journal: Journal of combinatorial chemistry 20070101

Title: Isolation and synthesis of allelochemicals from gramineae: benzoxazinones and related compounds.

Journal: Journal of agricultural and food chemistry 20060222

Title: Toward a novel class of antithrombotic compounds with dual function. Discovery of 1,4-benzoxazin-3(4H)-one derivatives possessing thrombin inhibitory and fibrinogen receptor antagonistic activities.

Journal: Journal of medicinal chemistry 20050505

Title: Design and synthesis of novel platelet fibrinogen receptor antagonists with 2H-1,4-benzoxazine-3(4H)-one scaffold. A systematic study.

Journal: European journal of medicinal chemistry 20050101

Title: Chemical basis for the antifeedant activity of natural hydroxamic acids and related compounds.

Journal: Journal of agricultural and food chemistry 20040505

Title: Utilisation of electrospray time-of-flight mass spectrometry for solving complex fragmentation patterns: application to benzoxazinone derivatives.

Journal: Journal of mass spectrometry : JMS 20031001

Title: Antitumor agents. Part 218: Cappamensin A, a new In vitro anticancer principle, from Capparis sikkimensis.

Journal: Bioorganic & medicinal chemistry letters 20030707

Title: Development of a liquid chromatography-electrospray-tandem mass spectrometry method for the quantitative determination of benzoxazinone derivatives in plants.

Journal: Analytical chemistry 20030701

Title: Effects of 1,4-benzoxazin-3-one derivatives from maize on survival and fecundity of Metopolophium dirhodum (Walker) on artificial diet.

Journal: Journal of chemical ecology 20010201

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