Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-(1-methylethyl)-1-piperazinyl)ethyl ester, dihydrochloride

Base Information

• Chemical Name: Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-(1-methylethyl)-1-piperazinyl)ethyl ester, dihydrochloride
• CAS No.: 141312-24-5
• Molecular Formula: C₂₃H₃₉N₃O₃*2ClH
• Molecular Weight: 478.503
• DSSTox Substance ID: DTXSID80161688
• Mol file: 141312-24-5.mol

Synonyms:2-(4-Isopropyl-1-piperazinyl)ethyl (2-(heptyloxy)phenyl)carbamate dihydrochloride;Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-(1-methylethyl)-1-piperazinyl)ethyl ester, dihydrochloride;141312-24-5;DTXSID80161688;LS-49834

Chemical Property of Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-(1-methylethyl)-1-piperazinyl)ethyl ester, dihydrochloride

Chemical Property:

• Vapor Pressure: 6.78E-10mmHg at 25°C
• Boiling Point: 493.9°Cat760mmHg
• Flash Point: 252.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 13
• Exact Mass: 477.2524976
• Heavy Atom Count: 31
• Complexity: 439

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)C(C)C.Cl.Cl

Technology Process of Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-(1-methylethyl)-1-piperazinyl)ethyl ester, dihydrochloride

There total 1 articles about Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-(1-methylethyl)-1-piperazinyl)ethyl ester, dihydrochloride 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: 70.0%

2-(n)-Heptyloxyphenyl isocyanate (55792-35-3) + 2-(4-isopropylpiperazin-1-yl)ethan-1-ol (103069-50-7) → (2-Heptyloxy-phenyl)-carbamic acid 2-(4-isopropyl-piperazin-1-yl)-ethyl ester; hydrochloride (141312-24-5)

Guidance literature:

With hydrogenchloride; 1) toluene, 3h, reflux, 2) Et₂O;

upstream raw materials:

2-(n)-Heptyloxyphenyl isocyanate

2-(4-isopropylpiperazin-1-yl)ethan-1-ol