N-(3-phenylprop-2-ynyl)butan-1-amine

Base Information

Chemical Name:N-(3-phenylprop-2-ynyl)butan-1-amine
CAS No.:445255-32-3
Molecular Formula:C13H17N
Molecular Weight:187.28100
Hs Code.:2921499090
DSSTox Substance ID:DTXSID30405903
Nikkaji Number:J1.796.428C
Mol file:445255-32-3.mol

Synonyms:445255-32-3;N-(3-phenylprop-2-ynyl)butan-1-amine;N-(3-phenylprop-2-yn-1-yl)butan-1-amine;N-BUTYL-3-PHENYL-2-PROPYN-1-AMINE;AN-465/42519157;N-BUTYL-3-PHENYLPROP-2-YN-1-AMINE;N-Butyl-3-phenylpropargylamine;DTXSID30405903;STK281133;AKOS000284618;N-butyl-N-(3-phenyl-2-propynyl)amine

Suppliers and Price of N-(3-phenylprop-2-ynyl)butan-1-amine

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

American Custom Chemicals Corporation
N-BUTYL-3-PHENYL-2-PROPYN-1-AMINE 95.00%
5MG
$ 504.37

Total 5 raw suppliers

Chemical Property of N-(3-phenylprop-2-ynyl)butan-1-amine

Chemical Property:

Vapor Pressure:0.00329mmHg at 25°C
Boiling Point:282.8oC at 760 mmHg
PKA:7.62±0.10(Predicted)
Flash Point:124.9oC
PSA：12.03000
Density:0.95g/cm3
LogP:2.81870
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:187.136099547
Heavy Atom Count:14
Complexity:190

Purity/Quality:

98% ^*data from raw suppliers

N-BUTYL-3-PHENYL-2-PROPYN-1-AMINE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCNCC#CC1=CC=CC=C1

Technology Process of N-(3-phenylprop-2-ynyl)butan-1-amine

There total 2 articles about N-(3-phenylprop-2-ynyl)butan-1-amine 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: 78.0%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 109-73-9,85404-21-3
N-butylamine

: 536-74-3
phenylacetylene

: 445255-32-3
N-(3-phenylprop-2-yn-1-yl)butan-1-amine

Guidance literature:: With polymer-supported L-proline copper complex; In dimethyl sulfoxide; at 20 ℃; for 12h;

Reference yield:

: 591-50-4
iodobenzene

: 44768-33-4
butyl(prop-2-ynyl)amine

: 445255-32-3
N-(3-phenylprop-2-yn-1-yl)butan-1-amine

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; at 25 ℃; for 6h; Inert atmosphere;
DOI:10.1021/acs.orglett.6b03021

Reference yield: 89.0%

: 445255-32-3
N-(3-phenylprop-2-yn-1-yl)butan-1-amine

: (Z)-N-(3-phenylallyl)butan-1-amine

Guidance literature:: N-(3-phenylprop-2-yn-1-yl)butan-1-amine; With niobium pentachloride; magnesium; In 1,2-dimethoxyethane; benzene; at 20 - 40 ℃; for 7h;

With potassium hydroxide; In 1,2-dimethoxyethane; diethyl ether; benzene; regioselective reaction; Cooling with ice;
DOI:10.3390/molecules26123722