n-(4-Chlorophenyl)-3-methylbutanamide

Base Information

Chemical Name:n-(4-Chlorophenyl)-3-methylbutanamide
CAS No.:7017-09-6
Molecular Formula:C11H14ClNO
Molecular Weight:211.688
Hs Code.:
NSC Number:34217
DSSTox Substance ID:DTXSID90990406
Nikkaji Number:J2.024.370H
Wikidata:Q82979882
Mol file:7017-09-6.mol

Synonyms:n-(4-chlorophenyl)-3-methylbutanamide;7017-09-6;Butanamide, N-(4-chlorophenyl)-3-methyl-;NSC34217;SCHEMBL12197936;DTXSID90990406;NSC-34217;STL377465;AKOS002341950

Suppliers and Price of n-(4-Chlorophenyl)-3-methylbutanamide

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
Packaging
price

Total 4 raw suppliers

Chemical Property of n-(4-Chlorophenyl)-3-methylbutanamide

Chemical Property:

Vapor Pressure:2.42E-05mmHg at 25°C
Melting Point:117-118 °C
Boiling Point:359.2°Cat760mmHg
PKA:14.25±0.70(Predicted)
Flash Point:171°C
PSA：29.10000
Density:1.148g/cm³
LogP:3.39760
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:211.0763918
Heavy Atom Count:14
Complexity:186

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)CC(=O)NC1=CC=C(C=C1)Cl

Technology Process of n-(4-Chlorophenyl)-3-methylbutanamide

There total 5 articles about n-(4-Chlorophenyl)-3-methylbutanamide 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: 63.0%

: 940-36-3
(4-chloro-phenyl)-carbamic acid methyl ester

: 100-99-2,130565-62-7
triisobutylaluminum

: 7017-09-6
N-(4-chloro-phenyl)-3-methyl-butyramide

Guidance literature:: In 1,2-dichloro-ethane; toluene; at -30 - 65 ℃; for 168h;
DOI:10.1021/ol036234f

Reference yield:

: 104-12-1
p-chlorphenylisocyanate

: 7017-09-6
N-(4-chloro-phenyl)-3-methyl-butyramide

Guidance literature:: With magnesium chloride; In dichloromethane; at 20 ℃; for 0.5h;
DOI:10.1039/d1ra02242c

Reference yield:

: 6622-16-8
benzyl (4-chlorophenyl)carbamate

: 7017-09-6
N-(4-chloro-phenyl)-3-methyl-butyramide

Guidance literature:: Multi-step reaction with 2 steps

1: 2-chloropyridine; trifluoromethylsulfonic anhydride / dichloromethane / 1.08 h / 20 °C

2: magnesium chloride / dichloromethane / 0.5 h / 20 °C

With 2-chloropyridine; trifluoromethylsulfonic anhydride; magnesium chloride; In dichloromethane;
DOI:10.1039/d1ra02242c