13358-49-1

Basic information

• Product Name: 1-phenylethyl benzoate
• Synonyms: Benzoic acid, 1-phenylethyl ester; Phenylethyl benzoate
• CAS NO: 13358-49-1
• Molecular Formula: C₁₅H₁₄O₂
• Molecular Weight: 226.2705
• Mol File: 13358-49-1.mol
• Article Data: 103

Chemical Properties

• Boiling Point: 327.3°C at 760 mmHg
• Flash Point: 143.1°C
• Density: 1.102g/cm³
• Vapor Pressure: 0.000204mmHg at 25°C
• Refractive Index: 1.567
• CAS DataBase Reference: 1-phenylethyl benzoate(CAS DataBase Reference)
• NIST Chemistry Reference: 1-phenylethyl benzoate(13358-49-1)
• EPA Substance Registry System: 1-phenylethyl benzoate(13358-49-1)

Safety Data

• Hazardous Substances Data: 13358-49-1(Hazardous Substances Data)

Usage

General Description

1-Phenylethyl benzoate is a chemical compound with the molecular formula C15H14O2. It is an ester formed from phenylethanol and benzoic acid. 1-phenylethyl benzoate is commonly used as a fragrance ingredient in perfumes and cosmetic products due to its sweet, floral, and fruity aroma. It is also utilized as a flavoring agent in food and beverages. In addition, 1-phenylethyl benzoate has potential applications in the pharmaceutical industry, where it may be used as an intermediate in the synthesis of various drugs and pharmaceutical compounds. 1-phenylethyl benzoate is known for its pleasant scent and is valued for its ability to enhance the olfactory profile of various products.

Upstream product

• 22293-10-3 (1-diazoethyl)benzene 
• 65-85-0 benzoic acid 
• 7007-15-0 3-benzoyl-1,3-oxazolidin-2-one 
• 591-50-4 iodobenzene 
• 201230-82-2 carbon monoxide 
• 98-85-1 1-Phenylethanol 
• 93-99-2 benzoic acid phenyl ester 
• 2040-37-1 benzyl 1-phenylethyl ether 
• 153729-80-7 (S)-3-benzoyl-4-tert-butyloxazolidin-2-one 
• 582-25-2 Potassium benzoate 
• 13893-90-8 benzoic acid isopropenyl ester 
• 14856-75-8 1-phenyl-1-trimethylsilyloxyethane 
• 93-97-0 benzoic acid anhydride 
• 105966-39-0 2-(1-phenylethoxy)-tetrahydro-2H-pyran 

Downstream Products

• 1445-91-6 (S)-1-phenylethanol 
• 1517-69-7 (R)-1-phenylethanol 
• 13358-49-1 (R)-(1-phenyl)-1-ethyl benzoate 
• 57473-79-7 benzoic acid (S)-1-phenylethyl ester 
• 10340-49-5 4-phenyl-1-pentene 
• 4044-60-4 2,5-dimethylbenzophenone 
• 38212-18-9 pent-1-ene-2,4-diyldibenzene 
• 116140-58-0 1,3-diphenyl-2-(1-phenyl-ethyl)-propane-1,3-dione 
• 100-41-4 ethylbenzene 
• 98-85-1 1-Phenylethanol 
• 614-16-4 Benzoylacetonitrile 
• 65-85-0 benzoic acid 
• 93-92-5 1-phenylethyl acetate 
• 100-42-5 styrene 

Relevant articles and documents

-

-

Studies directed toward the design of chiral acylating agents. the utility of chiral N-benzoylimides in enantioselective alcohol acylation

N-benzoyl-4(5)-tert-butyl-2-oxazolidinone (1b) is found to be an efficient enantioselective acylating agent for aryl n-alkyl carbinols. Selective benzoylation of racemic aryl n-alkyl carbinols with kinetic selectivities of 20-30:1 for the (R) enantiomer i

Nucleophilic Substitution of (Alkoxymethylene)dimethylammonium Chloride with Carboxylate Salts: a Convenient Procedure for the Synthesis of Esters with Inversion of Configuration

Secondary alcohols are converted into benzoate esters with inversion of configuration via sequential reaction with (chloromethylene)dimethylammonium chloride and potassium benzoate.

Two Approaches for CAL-B-Catalyzed Enantioselective Deacylation of a Set of α-Phenyl Ethyl Esters: Organic Solvent with Sodium Carbonate and Micro-aqueous Medium

Herein, we report an efficient enantioselective cleavage of the acyl- moiety of a set of α- phenyl ethyl esters with different chain-lengths catalyzed by lipase B from Candida antarctica (CAL-B) by comparing two reactional approaches: anhydrous media with sodium carbonates and micro-aqueous medium. The deacylation is performed in organic solvent, in the presence of Na2CO3 in the first case, and by addition of a drop of phosphate buffer solution pH 7 in the second. The results show the high efficiency of the deacylation in the presence of the sodium carbonate for the enzymatic resolution of all the esters and that in term of reactivity (31% ≤ conv ≤ 50%) and selectivity (E > 200). While, during the hydrolysis in micro-aqueous media, the conversion is strongly affected by the length of the acyl-chain side, the conversion decreases from conv = 50% with the 1-phenylethyl acetate 1a to conv = 19% with 1-phenyethyl dodecanoate 6a, and this, even if the selectivity remains high (E > 89). In both conditions, the lipase CAL-B shows a high enantioselectivities in favor of (R)-1-phenyl ethanol enantiomer (conv > 45%, E > 200) but the reactivity is modulated by the form and the size of the acyl-chain side. Graphic Abstract: [Figure not available: see fulltext.].

Preparation of alkylated compounds using the trialkylphosphate

[Problem] trialkylphosphate strong base used reaction agent, a carboxylic acid, a ketone, an aldehyde, amine, amide, thiol, ester or Grignard reagent to a variety of substrates, and/or high efficiency to generate a highly stereoselective alkylation reaction, the alkylated compounds capable of producing new means. [Solution] was used as the alkylating agent in the alkylation of compound trialkylphosphate, strongly basic reaction production use. [Drawing] no