116437-41-3

Basic information

• Product Name: (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER
• Synonyms: 4-(BOC-AMINO)-1-PHENYL-BUTAN-1-ONE;(4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER;(4-Oxo-4-phenyl-butyl)-carbamic acid tert-butyl;4-(BOC-AMINO)-1-PHENYL-BUTAN-1-ONE, (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER >98%;CarbaMic acid, N-(4-oxo-4-phenylbutyl)-, 1,1-diMethylethyl ester;tert-butyl 4-oxo-4-phenylbutylcarbaMate;N-(4-oxo-4-phenylbutyl)carbaMic acid tert-butyl ester;tert-Butyl N-(4-oxo-4-phenylbutyl)carbamate
• CAS NO: 116437-41-3
• Molecular Formula: C₁₅H₂₁NO₃
• Molecular Weight: 263.33
• Mol File: 116437-41-3.mol
• Article Data: 14

Chemical Properties

• Melting Point: 90-91°C
• Boiling Point: 406.8°Cat760mmHg
• Flash Point: 199.8°C
• Appearance: /
• Density: 1.058g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.507
• Storage Temp.: 2-8°C
• PKA: 12.66±0.46(Predicted)
• CAS DataBase Reference: (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER(116437-41-3)
• EPA Substance Registry System: (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER(116437-41-3)

Safety Data

• Hazardous Substances Data: 116437-41-3(Hazardous Substances Data)

Usage

General Description

(4-oxo-4-phenyl-butyl)-carbamic acid tert-butyl ester is a chemical compound with the molecular formula C16H21NO3. It is commonly used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER is a carbamate ester, which is a type of functional group in organic chemistry. It is typically synthesized through a series of chemical reactions, and it has a variety of potential applications in the pharmaceutical and agricultural industries. (4-OXO-4-PHENYL-BUTYL)-CARBAMIC ACID TERT-BUTYL ESTER has a range of physical and chemical properties that make it useful for specific applications, and it is important for researchers and manufacturers to understand its characteristics and potential uses in their work.

InChI:InChI=1/C15H21NO3/c1-15(2,3)19-14(18)16-11-7-10-13(17)12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3,(H,16,18)

Upstream product

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Downstream Products

• 98421-40-0 2,2,2-Trifluoro-1-((R)-2-phenyl-pyrrolidin-1-yl)-ethanone 
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• 700-91-4 2-phenyl-1-pyrroline 
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• 1386980-59-1 N-(5-(4-Amino-1-phenylbutylcarbamoyl)-2-chlorophenyl)-2-methoxy-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxamide 
• 357443-58-4 (4-Amino-4-phenylbutyl)carbamic acid, 1,1-dimethylethyl ester 
• 174311-02-5 2-phenylpyrrolidine-1-carboxylic acid tert-butyl ester 
• 885060-12-8 {3-[5-(3-fluorophenyl)-2-phenyl-2,3-dihydro-[1,3,4]thiadiazol-2-yl]-propyl}-carbamic acid tert-butyl ester 
• 1079843-41-6 {4-[(2,5-difluorobenzoyl)hydrazono]-4-phenylbutyl}-carbamic acid tert-butyl ester 

Relevant articles and documents

A One-Pot Approach to 2-Substituted-2-(Dimethoxyphosphoryl)-Pyrrolidines from Substituted tert-Butyl 4-Oxobutylcarbamates and Trimethyl Phosphite

A novel approach to 2-substituted-2-(dimethoxyphosphoryl)-pyrrolidines 7a-7o and 9a-9r has been developed, which features a TMSOTf-mediated one-pot intramolecular cyclization and phosphonylation of substituted tert-butyl 4-oxobutylcarbamates. The major advantages of this method include simple operation under mild reaction conditions, the use of cheap Lewis acid, and good to excellent yields with high diastereoselectivities (dr up to 99:1).

Iron-Catalysed Remote C(sp3)?H Azidation of O-Acyl Oximes and N-Acyloxy Imidates Enabled by 1,5-Hydrogen Atom Transfer of Iminyl and Imidate Radicals: Synthesis of γ-Azido Ketones and β-Azido Alcohols

In the presence of a catalytic amount of iron(III) acetylacetonate [Fe(acac)3], the reaction of structurally diverse ketoxime esters with trimethylsilyl azide (TMSN3) afforded γ-azido ketones in good to excellent yields. This unprecedented distal γ-C(sp3)?H bond azidation reaction went through a sequence of reductive generation of an iminyl radical, 1,5-hydrogen atom transfer (1,5-HAT) and iron-mediated redox azido transfer to the translocated carbon radical. TMSN3 served not only as a nitrogen source to functionalise the unactivated C(sp3)?H bond, but also as a reductant to generate the catalytically active FeII species in situ. Based on the same principle, a novel β-C(sp3)?H functionalisation of alcohols via N-acyloxy imidates was subsequently realised, leading, after hydrolysis of the resulting ester, to β-azido alcohols, which are important building blocks in organic and medicinal chemistry.

Probing the Effects of Heterocyclic Functionality in [(Benzene)Ru(TsDPENR)Cl] Catalysts for Asymmetric Transfer Hydrogenation

A range of TsDPEN catalysts containing heterocyclic groups on the amine nitrogen atom were prepared and evaluated in the asymmetric transfer hydrogenation of ketones. Bidentate and tridentate ligands demonstrated a mutual exclusivity directly related to their function as catalysts. A broad series of ketones were reduced with these new catalysts, permitting the ready identification of an optimal catalyst for each substrate and revealing the subtle effects that changes to nearby donor groups can exhibit.