996-97-4

Basic information

• Product Name: N,N-diethyloctanamide
• Synonyms: N,N-diethyloctanamide;DIETHYL CAPRYLAMIDE;Octanamide, N,N-diethyl-;Caprylic acid diethylamide
• CAS NO: 996-97-4
• Molecular Formula: C₁₂H₂₅NO
• Molecular Weight: 199.333
• EINECS: 213-639-7
• Mol File: 996-97-4.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 259.6 °C at 760 mmHg
• Flash Point: 97.1 °C
• Appearance: colorless transparent liquid
• Density: 0.862 g/cm³
• Vapor Pressure: 0.0128mmHg at 25°C
• Refractive Index: 1.444
• PKA: -0.40±0.70(Predicted)
• CAS DataBase Reference: N,N-diethyloctanamide(CAS DataBase Reference)
• NIST Chemistry Reference: N,N-diethyloctanamide(996-97-4)
• EPA Substance Registry System: N,N-diethyloctanamide(996-97-4)

Safety Data

• Hazardous Substances Data: 996-97-4(Hazardous Substances Data)

Usage

Uses

N,N-Diethyloctanamide can be used in heavy metal wastewater treatment.

Synthesis Reference(s)

Journal of the American Chemical Society, 89, p. 6804, 1967 DOI: 10.1021/ja01001a097The Journal of Organic Chemistry, 58, p. 6118, 1993 DOI: 10.1021/jo00074a046

InChI:InChI=1/C12H25NO/c1-4-7-8-9-10-11-12(14)13(5-2)6-3/h4-11H2,1-3H3

Upstream product

• 124-07-2 Octanoic acid 
• 88-10-8 N,N-diethylcarbamyl chloride 
• 103-49-1 dibenzylamine 
• 768-66-1 2,2,6,6-tetramethyl-piperidine 
• 124-02-7 diallylamine 
• 123-30-8 4-amino-phenol 
• 38761-67-0 1-bromo-1-octyne 
• 109-89-7 diethylamine 
• 2430-01-5 2-bromo-N,N-diethylacetamide 
• 42371-64-2 9-hexyl-9-borabicyclo[3.3.1]nonane 
• 592-41-6 1-hexene 
• 7380-82-7 N,N-diethyl-2-(dimethylsulfuranylidene)acetamide 
• 1188-92-7 Trihexylboran; Tri-n-hexylbor 
• 111-64-8 n-octanoic acid chloride 

Downstream Products

• 111-87-5 octanol 
• 124-13-0 Octanal 

Relevant articles and documents

PROCESS FOR PREPARATION OF N,N-DI SUBSTITUTED CARBOXAMIDES

The present disclosure relates to a single pot process for preparation of a N,N-di substituted carboxamide compounds of formula (I), said process comprising: reacting a carboxylic acid with a di-substituted carbamoyl chloride in presence of an organic tertiary base to obtain the N,N-di substituted carboxamide compounds of formula (I). The process of the present disclosure involves a simple step, and it is energy and time saving process for preparation of N,N-di substituted carboxamides.

XtalFluor-E, an efficient coupling reagent for amidation of carboxylic acids

Amides were produced from carboxylic acids and amines by using XtalFluor-E as an activator. Even poorly reactive carboxylic acids can be transformed to amides. In addition, optically active amines and/or carboxylic acids were not epimerized/racemized during the process.

Niobium pentachloride promoted conversion of carboxylic acids to carboxamides: Synthesis of the 4-aryl-1,2,3,4-tetrahydroisoquinoline alkaloid structures

A practical method for the conversion of carboxylic acids to the corresponding carboxamides mediated by niobium pentachloride under mild conditions is described. The synthesis of the 4-aryl-1,2,3,4-tetrahydroisoquinoline alkaloid structures was accomplished via benzylic lithiation of N-methyl-3,4-dimethoxy-2-(4′-methoxybenzyl)benzamide.