778617-65-5

Basic information

• Product Name: (2-OXO-2-P-TOLYL-ETHYL)-CARBAMIC ACID TERT-BUTYL ESTER
• Synonyms: (2-OXO-2-P-TOLYL-ETHYL)-CARBAMIC ACID TERT-BUTYL ESTER;tert-butyl N-[2-(4-methylphenyl)-2-oxoethyl]carbamate
• CAS NO: 778617-65-5
• Molecular Formula: C14H19NO3
• Molecular Weight: 249.30556
• Mol File: 778617-65-5.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 392.1°C at 760 mmHg
• Flash Point: 191°C
• Appearance: /
• Density: 1.074g/cm³
• Vapor Pressure: 2.34E-06mmHg at 25°C
• Refractive Index: 1.511
• PKA: 10.91±0.46(Predicted)
• CAS DataBase Reference: (2-OXO-2-P-TOLYL-ETHYL)-CARBAMIC ACID TERT-BUTYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: (2-OXO-2-P-TOLYL-ETHYL)-CARBAMIC ACID TERT-BUTYL ESTER(778617-65-5)
• EPA Substance Registry System: (2-OXO-2-P-TOLYL-ETHYL)-CARBAMIC ACID TERT-BUTYL ESTER(778617-65-5)

Safety Data

• Hazardous Substances Data: 778617-65-5(Hazardous Substances Data)

Usage

General Description

(2-oxo-2-p-tolyl-ethyl)-carbamic acid tert-butyl ester is a chemical compound with the formula C13H17NO3. It is a carbamate ester, which is a common functional group in many pesticide and herbicide molecules. The compound is often used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It is a colorless to light yellow liquid with a slight aromatic odor, and it is soluble in organic solvents. (2-OXO-2-P-TOLYL-ETHYL)-CARBAMIC ACID TERT-BUTYL ESTER is primarily used in the manufacturing process and is not commonly found in consumer products.

InChI:InChI=1/C14H19NO3/c1-10-5-7-11(8-6-10)12(16)9-15-13(17)18-14(2,3)4/h5-8H,9H2,1-4H3,(H,15,17)

Upstream product

• 24424-99-5 di-tert-butyl dicarbonate 
• 5467-70-9 2-amino-4'-methylacetophenone hydrochloride 
• 619-41-0 4-(bromoacetyl)toluene 
• 121505-93-9 tert-butyl N-{[methoxy(methyl)carbamoyl]methyl}carbamate 
• 4294-57-9 para-methylphenylmagnesium bromide 

Relevant articles and documents

Design, synthesis and evaluation of novel 5-phenylthiophene derivatives as potent fungicidal of Candida albicans and antifungal reagents of fluconazole-resistant fungi

A series of 5-phenylthiophene derivatives with novel structures were designed and synthesized to combat the increasing incidence of susceptible and drug-resistant fungal infections. The antifungal activity of the synthesized compounds was assessed against seven susceptible strains and six fluconazole-resistant strains. It is especially encouraging that compounds 17b and 17f displayed significant antifungal activities against all tested strains. Furthermore, the potent compounds 17b and 17f could prevent the formation of fungi biofilms and 17f displayed satisfactory fungicidal activity. Preliminary mechanistic studies showed that the potent antifungal activity of compound 17f stemmed from inhibition of C. albicans CYP51. In addition, Compounds 17b and 17f were almost nontoxic to mammalian A549, MCF-7, and THLE-2 cells. These results strongly suggested that compounds 17b and 17f are promising as novel antifungal drugs.

Stereoselective Pd-Catalyzed Decarboxylative Allylation: Assembly of Highly Functionalized Allylic Amines Bearing a Quaternary Center

Here, we report a practical and reliable methodology to direct construction of tri- and tetrasubstituted olefins bearing an allylic amine, with the concomitant construction of the sterically congested quaternary stereocenter through stereoselective pallad