61824-46-2

Basic information

• Product Name: p-propylphenyl acetate
• Synonyms: p-propylphenyl acetate;4-Propylphenyl acetate;Acetic acid 4-propylphenyl ester
• CAS NO: 61824-46-2
• Molecular Formula: C₁₁H₁₄O₂
• Molecular Weight: 178.22766
• EINECS: 263-249-6
• Mol File: 61824-46-2.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 252.3°C at 760 mmHg
• Flash Point: 95.9°C
• Appearance: /
• Density: 1.01g/cm³
• Vapor Pressure: 0.0195mmHg at 25°C
• Refractive Index: 1.498
• CAS DataBase Reference: p-propylphenyl acetate(CAS DataBase Reference)
• NIST Chemistry Reference: p-propylphenyl acetate(61824-46-2)
• EPA Substance Registry System: p-propylphenyl acetate(61824-46-2)

Safety Data

• Hazardous Substances Data: 61824-46-2(Hazardous Substances Data)

Usage

InChI:InChI=1/C11H14O2/c1-3-4-10-5-7-11(8-6-10)13-9(2)12/h5-8H,3-4H2,1-2H3

Upstream product

• 645-56-7 4-n-Propylphenol 
• 75-36-5 acetyl chloride 
• 108-24-7 acetic anhydride 
• 3240-34-4 [bis(acetoxy)iodo]benzene 
• 103-65-1 phenylpropane 

Downstream Products

• 1990-24-5 2-hydroxy-5-n-propyl-acetophenone 
• 742078-65-5 2-acetyl-4-propylphenyl benzoate 
• 742078-76-8 1-(2-hydroxy-5-propylphenyl)-3-phenylpropane-1,3-dione 
• 3354-53-8 2-ethyl-4-propylphenol 
• 855839-47-3 acetic acid-(2-ethyl-4-propyl-phenyl ester) 
• 1391854-10-6 (R)-1-phenyl-2,2,2-trichloroethyl (R)-1-(4-acetoxyphenyl)propylcarbamate 
• 1391854-11-7 C₂₀H₂₀Cl₃NO₄ 
• 714-23-8 4-(2-oxopropyl)phenyl acetate 
• 25743-56-0 4-(1-oxopropyl)phenyl acetate 
• 129319-15-9 (+/-)-2',3'-dihydroacetoxychavicol acetate 

Relevant articles and documents

Palladium-catalyzed acetoxylation of arenes by novel sulfinyl n-heterocyclic carbene ligand complexes

A series of novel ligands based on N-heterocyclic carbene and sulfoxide functionalities have been prepared and characterized. Pd(II) complexes have been synthesized by transmetalation from the corresponding NHC-Ag derivatives, and their behavior as catalysts has been studied in arene C-H bond oxidative activation. Studies conducted toward the elucidation of the reaction mechanism of the acetoxylation suggest a C-H activation step at Pd(IV) rather than Pd(II) intermediates.

Synthesis and evaluation of [2-(4-quinolyloxy)phenyl]methanone derivatives: Novel selective inhibitors of transforming growth factor-β kinase

We synthesized and evaluated various [2-(4-quinolyloxy)phenyl]methanone derivatives. These compounds had novel chemical structures that were distinct from those of previously reported inhibitors. Biological data suggested that these compounds inhibited transforming growth factor-β signaling by interacting with the ATP-binding pocket of the transforming growth factor-β type I receptor kinase domain. Here, we report on the synthesis and structure-activity relationships of the compounds in this series.

Refinement and evaluation of a pharmacophore model for flavone derivatives binding to the benzodiazepine site of the GABAA receptor

To further develop and evaluate a pharmacophore model previously proposed by Cook and co-workers (Drug Des. Discovery 1995, 12, 193-248) for ligands binding to the benzodiazepine site of the GABAA receptor, 40 new flavone derivatives have been synthesized and their affinities for the benzodiazepine site have been determined. Two new regions of steric repulsive interactions between ligand and receptor have been characterized, and the receptor region in the vicinity of 6- and 3′-substituents has been mapped out. 2′-Hydroxy substitution is shown to give a significant increase in affinity, which is interpreted in terms of a novel hydrogen bond interaction with the previously proposed hydrogen bond-accepting site A2. On the basis of the results of these studies and the refined pharmacophore model, 5′-bromo-2′-hydroxy-6-methylflavone, the highest affinity flavone derivative reported so far (Ki = 0.9 nM), was successfully designed. A comparison of the pharmacophore model with a recently proposed alternative model (Marder; et al. Bioorg. Med. Chem., 2001, 9, 323-335) has been made.