1-(2-Amino-3-propylphenyl)-2-chloroethanone

Base Information

Chemical Name:1-(2-Amino-3-propylphenyl)-2-chloroethanone
CAS No.:128600-54-4
Molecular Formula:C₁₁H₁₄ClNO
Molecular Weight:211.691
Hs Code.:
DSSTox Substance ID:DTXSID00563463
Wikidata:Q82447905
Mol file:128600-54-4.mol

Synonyms:128600-54-4;1-(2-amino-3-propylphenyl)-2-chloroethanone;Ethanone, 1-(2-amino-3-propylphenyl)-2-chloro- (9CI);DTXSID00563463;1-(2-Amino-3-propylphenyl)-2-chloroethan-1-one

Suppliers and Price of 1-(2-Amino-3-propylphenyl)-2-chloroethanone

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 2 raw suppliers

Chemical Property of 1-(2-Amino-3-propylphenyl)-2-chloroethanone

Chemical Property:

Melting Point:60-61 °C
Boiling Point:349.2±32.0 °C(Predicted)
PKA:-0.11±0.13(Predicted)
PSA：43.09000
Density:1.150±0.06 g/cm3(Predicted)
LogP:3.22400
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:211.0763918
Heavy Atom Count:14
Complexity:196

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC1=C(C(=CC=C1)C(=O)CCl)N

Technology Process of 1-(2-Amino-3-propylphenyl)-2-chloroethanone

There total 1 articles about 1-(2-Amino-3-propylphenyl)-2-chloroethanone 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:

: 107-14-2
chloroacetonitrile

: 1821-39-2
2-propylaniline

: 128600-54-4
1-(2-Amino-3-propyl-phenyl)-2-chloro-ethanone

Guidance literature:: With aluminium trichloride; boron trichloride; Yield given. Multistep reaction; 1.) toluene, CH₂Cl₂, 0 deg C, 5 min, 2.) reflux, 6 h;
DOI:10.1021/jm00172a016

Reference yield:

: 128600-54-4
1-(2-Amino-3-propyl-phenyl)-2-chloro-ethanone

: 128600-57-7
7-n-propylindole-3-carboxaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: NaBH₄ / dioxane; H₂O / 6 h / Heating

2: 1.) POCl₃ / 1.) 0 deg C, 30 min, 2.) 15-42 deg C, 1 h

With sodium tetrahydroborate; trichlorophosphate; In 1,4-dioxane; water;
DOI:10.1021/jm00172a016