Octylazanium;chloride

Base Information

• Chemical Name: Octylazanium;chloride
• CAS No.: 142-95-0
• Molecular Formula: C8H19N.ClH
• Molecular Weight: 165.706
• Hs Code.: 2921199090
• Mol file: 142-95-0.mol

Synonyms:octylazanium;chloride;NS00079054

Chemical Property of Octylazanium;chloride

Chemical Property:

• Melting Point: 198°C(lit.)
• Boiling Point: 179.4 °C at 760 mmHg
• Flash Point: 62.8 °C
• PSA: 26.02000
• LogP: 3.80790
• Water Solubility.: Soluble in water
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 165.1284273
• Heavy Atom Count: 10
• Complexity: 43.8

Purity/Quality:

99%, ^*data from raw suppliers

OctylamineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 36/37/38-22
• Safety Statements: 36/37/39-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC[NH3+].[Cl-]

Technology Process of Octylazanium;chloride

There total 11 articles about Octylazanium;chloride 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: 100.0%

n-Octylamine (111-86-4) → n-octylamine hydrochloride (142-95-0)

Guidance literature:

With hydrogenchloride; In diethyl ether; water; at 20 ℃; for 0.333333h;

DOI:10.1002/chem.201000573

Reference yield: 95.0%

caprylnitrile (124-12-9) → n-octylamine hydrochloride (142-95-0)

Guidance literature:

caprylnitrile; With cobalt pivalate; 1,1,3,3-Tetramethyldisiloxane; tert-butylisonitrile; at 80 ℃; for 24h;

With hydrogenchloride; In diethyl ether; at 20 ℃; for 0.5h;

DOI:10.1021/acs.orglett.8b03736

Reference yield: 90.0%

1-nitrooctane (629-37-8) → n-octylamine hydrochloride (142-95-0)

Guidance literature:

1-nitrooctane; With C₃₆H₅₆Cl₃CrN₂O; magnesium; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; In tetrahydrofuran; at 60 ℃; for 24h; Inert atmosphere; Schlenk technique;

With hydrogenchloride; In tetrahydrofuran; water; ethyl acetate; at 20 ℃;

DOI:10.1021/jacs.0c12318

upstream raw materials:

N-octyl-4-methylbenzenesulfonamide

N,N-Bis(phenylmethyl)octanamine

isopropylidene-octyl-amine

caprylnitrile

Downstream raw materials:

4-(octylamino)pyridine

octenidine dihydrochloride

N-octyldodecanamide

1-(p-Chlor-phenyl)-3-n-octyl-harnstoff

Refernces

• 1、 Ghosh, Chandradhish,Konai, Mohini Mohan,Sarkar, Paramita,Samaddar, Sandip,Haldar, Jayanta. "Designing Simple Lipidated Lysines: Bifurcation Imparts Selective Antibacterial Activity". . p. 2367 - 2371. Retrieved 2016.
• 2、 Zhao, Lixing,Hu, Chenyang,Cong, Xuefeng,Deng, Gongda,Liu, Liu Leo,Luo, Meiming,Zeng, Xiaoming. "Cyclic (Alkyl)(amino)carbene Ligand-Promoted Nitro Deoxygenative Hydroboration with Chromium Catalysis: Scope, Mechanism, and Applications". supporting information. p. 1618 - 1629. Retrieved 2021/01/25.
• 3、 Weber, Stefan,Veiros, Luis F.,Kirchner, Karl. "Old Concepts, New Application – Additive-Free Hydrogenation of Nitriles Catalyzed by an Air Stable Alkyl Mn(I) Complex". supporting information. p. 5412 - 5420. Retrieved 2019/11/13.