Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-morpholinyl)ethyl ester, monohydrochloride

Base Information

• Chemical Name: Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-morpholinyl)ethyl ester, monohydrochloride
• CAS No.: 102609-68-7
• Molecular Formula: C₂₀H₃₂N₂O₄*ClH
• Molecular Weight: 400.946
• DSSTox Substance ID: DTXSID70145351
• Mol file: 102609-68-7.mol

Synonyms:Carbanilic acid, o-(heptyloxy)-, 2-morpholinoethyl ester, hydrochloride;1-Morpholineethanol, o-heptyloxycarbanilate, hydrochloride;o-(Heptyloxy)carbanilic acid 2-morpholinoethyl ester hydrochloride;Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-morpholinyl)ethyl ester, monohydrochloride;102609-68-7;DTXSID70145351;LS-51261

Chemical Property of Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-morpholinyl)ethyl ester, monohydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 400.2128852
• Heavy Atom Count: 27
• Complexity: 375

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCOCC2.Cl

Technology Process of Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-morpholinyl)ethyl ester, monohydrochloride

There total 4 articles about Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-morpholinyl)ethyl ester, monohydrochloride 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:

2-(morpholin-4-yl)ethanol (622-40-2) + 2-(n)-Heptyloxyphenyl isocyanate (55792-35-3) → (2-Heptyloxy-phenyl)-carbamic acid 2-morpholin-4-yl-ethyl ester; hydrochloride (102609-68-7)

Guidance literature:

With hydrogenchloride; Yield given. Multistep reaction; 1) toluene, 3 h, reflux, 2) ether;

Reference yield:

acetic acid-(2-heptyloxy-anilide) (55792-58-0) → (2-Heptyloxy-phenyl)-carbamic acid 2-morpholin-4-yl-ethyl ester; hydrochloride (102609-68-7)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogenchloride / water / 2 h / Reflux

2: toluene / 3 h / Reflux

3: toluene / 3 h / Reflux

With hydrogenchloride; In water; toluene;

DOI:10.3390/molecules23051064

Reference yield:

2-amino-phenol (95-55-6) → (2-Heptyloxy-phenyl)-carbamic acid 2-morpholin-4-yl-ethyl ester; hydrochloride (102609-68-7)

Guidance literature:

Multi-step reaction with 5 steps

1: 1 h / 20 °C

2: sodium; ethanol / 3 h / Reflux

3: hydrogenchloride / water / 2 h / Reflux

4: toluene / 3 h / Reflux

5: toluene / 3 h / Reflux

With hydrogenchloride; ethanol; sodium; In water; toluene;

DOI:10.3390/molecules23051064

upstream raw materials:

2-(morpholin-4-yl)ethanol

2-(n)-Heptyloxyphenyl isocyanate

acetic acid-(2-heptyloxy-anilide)

2-amino-phenol

Refernces

• 1、 Cizmarik,Borovansky,Tumova. "Local anesthetics. 91. Morpholinoethylester of alkoxyphenylcarbamidic acid". . p. 702 - 703. Retrieved 2007/10/02.