90178-72-6

Basic information

• Product Name: 4-(3-formylphenoxy)benzonitrile
• Synonyms: 4-(3-formylphenoxy)benzonitrile;Benzonitrile, 4-(3-formylphenoxy)-;4-(3- mylphenoxy)benzonitrile
• CAS NO: 90178-72-6
• Molecular Formula: C₁₄H₉NO₂
• Molecular Weight: 223.22676
• Mol File: 90178-72-6.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 408.7±25.0 °C(Predicted)
• Appearance: /
• Density: 1.24±0.1 g/cm3(Predicted)
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility: Chloroform (Slightly), Methanol (Slightly)
• CAS DataBase Reference: 4-(3-formylphenoxy)benzonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(3-formylphenoxy)benzonitrile(90178-72-6)
• EPA Substance Registry System: 4-(3-formylphenoxy)benzonitrile(90178-72-6)

Safety Data

• Hazardous Substances Data: 90178-72-6(Hazardous Substances Data)

Usage

Uses

4-(3-Formylphenoxy)benzonitrile is a useful reagent for the synthetic preparation of antimicrobial biscationic 2-(phenoxyphenyl)indoles and 1-Benzofurans.

Upstream product

• 87199-16-4 3-Formylphenylboronic acid 
• 767-00-0 4-cyanophenol 
• 1194-02-1 4-fluorobenzonitrile 
• 100-83-4 meta-hydroxybenzaldehyde 

Downstream Products

• 888967-63-3 4-(3-(hydroxymethyl)phenoxy)benzonitrile 
• 90178-94-2 6-(2-Imidazolin-2-yl)-2-<3-<4-(2-imidazolin-2-yl)phenoxy>phenyl>indol-dihydrochlorid 
• 90178-88-4 2-<3-(4-Amidinophenoxy)phenyl>indol-6-carboxamidin-dihydrochlorid 
• 90178-66-8 2-<3-(4-Cyanphenoxy)phenyl>indol-6-carbonitril 
• 90178-70-4 4-Cyan-3'-(4-cyanphenoxy)-2-nitrostilben 
• 915389-89-8 4-(3-formylphenoxy)benzoic acid 

Relevant articles and documents

Preparation method of 5-(4-cyanophenoxy)-2, 3-dihydro-1-hydroxy-2, 1-benzoxaborole intermediate

The invention discloses a preparation method of 5-(4-cyanophenoxy)-2, 3-dihydro-1-hydroxy-2, 1-benzoxaborole intermediate. The 5-(4-cyanophenoxy)-2, 3-dihydro-1-hydroxy-2, 1-benzoxaborole intermediatecomprises a structure as shown in a formula IV. The pre

Probing the Hydrophobic Binding Pocket of G-Protein-Coupled Lysophosphatidylserine Receptor GPR34/LPS1 by Docking-Aided Structure-Activity Analysis

The ligands of certain G-protein-coupled receptors (GPCRs) have been identified as endogenous lipids, such as lysophosphatidylserine (LysoPS). Here, we analyzed the molecular basis of the structure-activity relationship of ligands of GPR34, one of the LysoPS receptor subtypes, focusing on recognition of the long-chain fatty acid moiety by the hydrophobic pocket. By introducing benzene ring(s) into the fatty acid moiety of 2-deoxy-LysoPS, we explored the binding site's preference for the hydrophobic shape. A tribenzene-containing fatty acid surrogate with modifications of the terminal aromatic moiety showed potent agonistic activity toward GPR34. Computational docking of these derivatives with a homology modeling/molecular dynamics-based virtual binding site of GPR34 indicated that a kink in the benzene-based lipid surrogates matches the L-shaped hydrophobic pocket of GPR34. A tetrabenzene-based lipid analogue bearing a bulky tert-butyl group at the 4-position of the terminal benzene ring exhibited potent GPR34 agonistic activity, validating the present hydrophobic binding pocket model.

Syntheses of antimicrobial biscationic 2-(phenoxyphenyl)indoles and 1-1benzofurans

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