Salicylamide, N-isopropyl-

Base Information

• Chemical Name: Salicylamide, N-isopropyl-
• CAS No.: 551-35-9
• Molecular Formula: C10H13 N O2
• Molecular Weight: 179.22
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID50203620
• Nikkaji Number: J6.715F
• Wikidata: Q83077023
• Mol file: 551-35-9.mol

Synonyms:Salicylamide, N-isopropyl-;551-35-9;N-Isopropylsalicylamide;2-hydroxy-n-isopropylbenzamide;2-hydroxy-N-propan-2-ylbenzamide;Benzamide, 2-hydroxy-N-(1-methylethyl)-;BRN 2834135;S 2-127;N-Isopropyl-salicylamid;Salicylsaureisopropylamid;SCHEMBL6105988;DTXSID50203620;AKOS000207782;LS-144168;FT-0632372;A830501;Z235569628

Chemical Property of Salicylamide, N-isopropyl-

Chemical Property:

• Vapor Pressure: 3.13E-05mmHg at 25°C
• Boiling Point: 345.2°Cat760mmHg
• Flash Point: 162.6°C
• PSA: 52.82000
• Density: 1.109g/cm³
• LogP: 2.10520
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 179.094628657
• Heavy Atom Count: 13
• Complexity: 180

Purity/Quality:

98%min ^*data from raw suppliers

N-ISOPROPYLSALICYLAMIDE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)NC(=O)C1=CC=CC=C1O

Technology Process of Salicylamide, N-isopropyl-

There total 8 articles about Salicylamide, N-isopropyl- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 70.0%

N-isopropylbenzamide (5440-69-7) → 2-hydroxy-N-isopropylbenzamide (551-35-9)

Guidance literature:

With sodium persulfate; palladium diacetate; In 1,4-dioxane; at 80 ℃; for 16h; Inert atmosphere;

DOI:10.1039/c4cc06864e

Reference yield: 67.0%

isopropylamine (75-31-0) + salicylic acid (69-72-7,25496-36-0,8052-31-1) → 2-hydroxy-N-isopropylbenzamide (551-35-9)

Guidance literature:

With cetyltrimethylammonim bromide; O,O-Diethyl hydrogen phosphorodithioate; In toluene; for 11h; Heating;

Reference yield: 56.0%

C13H12O7 + isopropylamine (75-31-0) → 2-hydroxy-N-isopropylbenzamide (551-35-9)

Guidance literature:

With dmap; 1,8-diazabicyclo[5.4.0]undec-7-ene; In acetonitrile; at 20 ℃; for 8h;

DOI:10.1039/d1ra05032j

upstream raw materials:

isopropylamine

salicylic acid

3-Isopropyl-benzo[e][1,3]oxazine-2,4-dione

N-isopropylbenzamide

Downstream raw materials:

2-β-D-galactopyranosyloxy-benzoic acid isopropylamide

2-(tetra-O-acetyl-β-D-glucopyranosyloxy)-benzoic acid isopropylamide

Refernces

• 1、 Seth, Kapileswar,Nautiyal, Manesh,Purohit, Priyank,Parikh, Naisargee,Chakraborti, Asit K.. "Palladium catalyzed Csp2-H activation for direct aryl hydroxylation: The unprecedented role of 1,4-dioxane as a source of hydroxyl radicals". supporting information. p. 191 - 194. Retrieved 2015/01/09.
• 2、 Hossain,Borthakur. "O,O-Diethyldithiophosphoric acid. A new condensing agent for acylation of amines by carboxylic acid". . p. 1062 - 1063. Retrieved 2007/10/02.