9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-

Base Information

Chemical Name:9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-
CAS No.:96513-74-5
Molecular Formula:C₂₆H₄₁NO₃
Molecular Weight:415.616
Hs Code.:
DSSTox Substance ID:DTXSID70242298
Nikkaji Number:J326.068B
Wikidata:Q83125945
Pharos Ligand ID:7928X4SU15PP
ChEMBL ID:CHEMBL121730

Synonyms:N-((4-Hydroxy-3-methoxyphenyl)methyl)-9-octadecynamide;9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-;CHEMBL121730;96513-74-5;N-Vanilyl-9-octadecynamide;N-vanillyl-9-octadecynamide;SCHEMBL10545511;DTXSID70242298;BBRZZCYVWKZJJY-UHFFFAOYSA-N;BDBM50473850;LS-97735

Suppliers and Price of 9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 0 raw suppliers

Chemical Property of 9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-

Chemical Property:

Vapor Pressure:6.42E-15mmHg at 25°C
Boiling Point:598.5°Cat760mmHg
Flash Point:315.8°C
Density:1.002g/cm³
XLogP3:7.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:16
Exact Mass:415.30864417
Heavy Atom Count:30
Complexity:493

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCC#CCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC

Technology Process of 9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-

There total 3 articles about 9-Octadecynamide, N-((4-hydroxy-3-methoxyphenyl)methyl)- 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: 75.0%

: 506-24-1
Stearolic acid

: 7149-10-2
vanillylamine hydrochloride

: 96513-74-5
N-vanillyl-9-octadecynamide

Guidance literature:: With propylphosphonic anhydride; triethylamine; In dichloromethane; at 0 - 20 ℃;
DOI:10.1021/jm020844o

Reference yield: 54.0%

: 1196-92-5
Vanillylamin

: 60010-36-8
octadec-9-ynoyl chloride

: 96513-74-5
N-vanillyl-9-octadecynamide

Guidance literature:: In diethyl ether; N,N-dimethyl-formamide; Ambient temperature;
DOI:10.1021/jm00070a002

Reference yield:

: 506-24-1
Stearolic acid

: 96513-74-5
N-vanillyl-9-octadecynamide

Guidance literature:: Multi-step reaction with 2 steps

1: oxalyl chloride / 3 h

2: 54 percent / dimethylformamide; diethyl ether / Ambient temperature

With oxalyl dichloride; In diethyl ether; N,N-dimethyl-formamide;
DOI:10.1021/jm00070a002