1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)

Base Information

• Chemical Name: 1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)
• CAS No.: 70775-75-6
• Molecular Formula: C36H64Cl2N4
• Molecular Weight: 623.837
• Hs Code.: 2933399990
• Mol file: 70775-75-6.mol

Synonyms:SCHEMBL126751;1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)

Chemical Property of 1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)

Chemical Property:

• Vapor Pressure: 0Pa at 25℃
• Melting Point: 215-217 °C
• Boiling Point: 609.3 °C at 760 mmHg
• Flash Point: 322.3 °C
• PSA: 31.82000
• Density: 1.046[at 20℃]
• LogP: 3.78140
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Solubility.: Soluble in dimethyl sulfoxide and methanol.
• Water Solubility.: 14.2g/L at 20℃
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 25
• Exact Mass: 586.4741257
• Heavy Atom Count: 41
• Complexity: 691

Purity/Quality:

Octenidine Dihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCN=C1C=CN(C=C1)CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2.Cl
• Uses: Octenidine is an antiseptic (topical). Octenidine is a cationic surfactant and bis-(dihydropyridinyl)-decane derivative. Octenidine dihydrochloride is used as a antiseptic for skin, mucous Membranes and wounds.

Technology Process of 1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)

There total 4 articles about 1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2) 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: 94.2%

1,10-bis-(4-chloropyridin-1 (4H)-yl)decane + n-octylamine hydrochloride (142-95-0) → octenidine dihydrochloride (70775-75-6)

Guidance literature:

In N,N-dimethyl-formamide; at 160 ℃; Inert atmosphere;

Reference yield: 85.1%

1,10-dichlorodecane (2162-98-3) + 4-(octylamino)pyridine (64690-19-3) → octenidine dihydrochloride (70775-75-6)

Guidance literature:

In acetic acid butyl ester; for 12h; Reflux;

Reference yield:

4-aminopyridine (504-24-5) → octenidine dihydrochloride (70775-75-6)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogen; palladium 10% on activated carbon / ethanol / 80 °C / 2625.26 Torr

2: acetic acid butyl ester / 12 h / Reflux

With palladium 10% on activated carbon; hydrogen; In ethanol; acetic acid butyl ester;

upstream raw materials:

1,10-dichlorodecane

4-(octylamino)pyridine

n-octylamine hydrochloride

4-aminopyridine

Refernces

• 1、 -. "The improved method for preparing octenidine dihydrochloride and the method for preparing a pharmaceutical composition containing the octenidine dihydrochloride". Paragraph 0105; 0106. . Retrieved 2017/05/12.