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493-09-4,MFCD00006821
Catalog No.:AA003DJL

493-09-4 | 1,4-Benzodioxan

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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003DJL
Chemical Name:
1,4-Benzodioxan
CAS Number:
493-09-4
Molecular Formula:
C8H8O2
Molecular Weight:
136.1479
MDL Number:
MFCD00006821
SMILES:
C1COc2c(O1)cccc2
NSC Number:
406705
Properties
Properties
 
BP:
248.138°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.549(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
99.8  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
2  

Literature

Title: Design, modification and 3D QSAR studies of novel 2,3-dihydrobenzo[b][1,4]dioxin-containing 4,5-dihydro-1H-pyrazole derivatives as inhibitors of B-Raf kinase.

Journal: Bioorganic & medicinal chemistry 20121015

Title: Asymmetric synthesis and CD investigation of the 1,4-benzodioxane lignans eusiderins A, B, C, G, L, and M.

Journal: The Journal of organic chemistry 20120921

Title: Synthesis and antihepatotoxic activity of 5-(2,3-dihydro-1,4-benzodioxane-6-yl)-3-substituted-phenyl-4,5-dihydro-1H-pyrazole derivatives.

Journal: Bioorganic & medicinal chemistry letters 20111215

Title: Synthesis, biological evaluation, and molecular docking studies of 1,3,4-oxadiazole derivatives possessing 1,4-benzodioxan moiety as potential anticancer agents.

Journal: Bioorganic & medicinal chemistry 20111101

Title: Synthesis, biological evaluation and molecular docking studies of 1,3,4-thiadiazole derivatives containing 1,4-benzodioxan as potential antitumor agents.

Journal: Bioorganic & medicinal chemistry letters 20111015

Title: Synthesis and antitumor activity of 1,2,4-triazoles having 1,4-benzodioxan fragment as a novel class of potent methionine aminopeptidase type II inhibitors.

Journal: Bioorganic & medicinal chemistry 20111015

Title: Oxadiazole derivatives containing 1,4-benzodioxan as potential immunosuppressive agents against RAW264.7 cells.

Journal: Bioorganic & medicinal chemistry 20110815

Title: Rotationally resolved electronic spectroscopy of 1,4-benzodioxan: the anomeric effect in the ground and electronically excited state.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry 20110711

Title: Comparative Molecular Field Analysis (CoMFA) and Comparative Molecular Similarity Indices Analysis (CoMSIA) studies on α(1A)-adrenergic receptor antagonists based on pharmacophore molecular alignment.

Journal: International journal of molecular sciences 20110101

Title: 7-Phenyl-sulfonyl-2,3-dihydro-7H-1,4-benzodioxino[6,7-b]carbazole.

Journal: Acta crystallographica. Section E, Structure reports online 20101201

Title: Copper-catalyzed tandem process: an efficient approach to 2-substituted-1,4-benzodioxanes.

Journal: Organic & biomolecular chemistry 20100621

Title: Synthesis and glycogen phosphorylase inhibitory activity of N-(beta-D-glucopyranosyl)amides possessing 1,4-benzodioxane moiety.

Journal: Bioorganic & medicinal chemistry 20090915

Title: Synthesis, crystal structure and immunosuppressive activity of acylamide derivatives containing 1,4-benzodioxan.

Journal: ChemMedChem 20090901

Title: 5-(2-Pyrrolidinyl)oxazolidinones and 2-(2-pyrrolidinyl)benzodioxanes: synthesis of all the stereoisomers and alpha4beta2 nicotinic affinity.

Journal: Bioorganic & medicinal chemistry letters 20090201

Title: Structure-activity relationships in 1,4-benzodioxan-related compounds. 9. From 1,4-benzodioxane to 1,4-dioxane ring as a promising template of novel alpha1D-adrenoreceptor antagonists, 5-HT1A full agonists, and cytotoxic agents.

Journal: Journal of medicinal chemistry 20081023

Title: Experimental and computational thermochemistry of 1,4-benzodioxan and its 6-R derivatives.

Journal: The journal of physical chemistry. A 20080828

Title: Cation spectroscopy and binding energy determination for 1,4-benzodioxan-Ar1 and -Ar2 complexes.

Journal: The journal of physical chemistry. A 20080731

Title: Theoretical calculations and vibrational spectra of 1,4-benzodioxan in its S(1)(pi, pi*) electronic excited state.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20071231

Title: Synthesis and glycogen phosphorylase inhibitor activity of 2,3-dihydrobenzo[1,4]dioxin derivatives.

Journal: Bioorganic & medicinal chemistry 20070615

Title: A comparative study on absorption and selectivity of organic vapors by using ionic liquids based on imidazolium, quaternary ammonium, and guanidinium cations.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20070101

Title: Synthesis and alpha4beta2 nicotinic affinity of unichiral 5-(2-pyrrolidinyl)oxazolidinones and 2-(2-pyrrolidinyl)benzodioxanes.

Journal: Bioorganic & medicinal chemistry letters 20061101

Title: Laser-induced fluorescence spectra, structure, and the ring-twisting and ring-bending vibrations of 1,4-benzodioxan in its S0 and S1(pi,pi*) states.

Journal: The journal of physical chemistry. A 20060817

Title: Modulation of selective serotonin reuptake inhibitor and 5-HT1A antagonist activity in 8-aza-bicyclo[3.2.1]octane derivatives of 2,3-dihydro-1,4-benzodioxane.

Journal: Bioorganic & medicinal chemistry letters 20040119

Title: Structures of 1,4-benzodioxane derivatives from the seeds of Phytolacca americana and their neuritogenic activity in primary cultured rat cortical neurons.

Journal: Chemical & pharmaceutical bulletin 20031201

Title: A novel series of 2,6,7-substituted 2,3-dihydro-1,4-benzodioxin and 2,6,7-substituted 1,4-benzodioxin derivatives as lipid peroxidation inhibitors. Structure-activity relationships for high inhibition of human low-density lipoprotein peroxidation.

Journal: Journal of medicinal chemistry 20011108

Title: Total synthesis and antifungal activity of 9-methoxystrobilurin L as the originally proposed 1,4-benzodioxan structure.

Journal: Bioorganic & medicinal chemistry letters 20011022

Title: Novel p-arylthio cinnamides as antagonists of leukocyte function-associated antigen-1/intracellular adhesion molecule-1 interaction. 2. Mechanism of inhibition and structure-based improvement of pharmaceutical properties.

Journal: Journal of medicinal chemistry 20010412

Title: Antitumor agents. Synthesis and biological evaluation of new compounds related to podophyllotoxin, containing the 2,3-dihydro-1,4-benzodioxin system.

Journal: European journal of medicinal chemistry 20010401

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