N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride

Base Information

• Chemical Name: N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride
• CAS No.: 1786-81-8
• Molecular Formula: C13H20N2O^.HCl
• Molecular Weight: 256.776
• Hs Code.: 29242990
• Mol file: 1786-81-8.mol

Synonyms:CHEBI:32053;N-(2-methylphenyl)-N(2)-propylalaninamide hydrochloride;N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride

Chemical Property of N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride

Chemical Property:

• Appearance/Colour: White or off white crystalline powder
• Vapor Pressure: 2.05E-05mmHg at 25°C
• Melting Point: 168-170oC
• Boiling Point: 361.6 °C at 760 mmHg
• Flash Point: 134.3 °C
• PSA: 41.13000
• LogP: 3.58750
• Storage Temp.: Refrigerator
• Solubility.: Freely soluble in water and in ethanol (96 per cent), very slightly soluble in acetone
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 256.1342410
• Heavy Atom Count: 17
• Complexity: 218

Purity/Quality:

99% ^*data from raw suppliers

Prilocaine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC[NH2+]C(C)C(=O)NC1=CC=CC=C1C.[Cl-]
• Uses: antibacterial Propitocaine hydrochloride is a local anesthetic of the amino amide type,it is often used in dentistry. Prilocaine is also often combined with lidocaine as a preparation for dermal anesthesia (lidocaine/pril ocaine or EMLA), for treatment of conditions like paresthesia. Anesthetic (local).
• Biological Functions: Prilocaine hydrochloride (Citanest) is an amide anesthetic whose onset of action is slightly longer than that of lidocaine; its duration of action is comparable. Prilocaine is 40% less toxic acutely than lidocaine, making it especially suitable for regional anesthetic techniques. It is metabolized by the liver to orthotoluidine, which when it accumulates, can cause conversion of hemoglobin (HB+++ to methemoglobin (HB+++. Oxygen transport is impaired in the presence of methemoglobinemia. Treatment involves the use of reducing agents, such as methylene blue, given intravenously, to reconvert methemoglobin to hemoglobin.

Technology Process of N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride

There total 2 articles about N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium 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: 96.0%

prilocaine (721-50-6,14289-31-7) → prilocaine hydrochloride (1786-81-8)

Guidance literature:

With hydrogenchloride; In water; ethyl acetate; pH=1;

Reference yield: 95.05%

propylamine (107-10-8,42939-71-9) + 2-chloropropionyl chloride (7623-09-8) + o-toluidine (95-53-4) → prilocaine hydrochloride (1786-81-8)

Guidance literature:

2-chloropropionyl chloride; o-toluidine; In dichloromethane; at 20 - 22 ℃; for 2.5h;

propylamine; With hydrogenchloride; In water; for 7h; pH=1 - 2; Concentration; Temperature; Reflux;

Reference yield: 98.0%

potassium acesulfame (55589-62-3) + prilocaine hydrochloride (1786-81-8) → prilocaine acesulfamate

Guidance literature:

In acetonitrile; at 50 ℃; for 4h;

DOI:10.3390/molecules26040983

upstream raw materials:

propylamine

2-chloropropionyl chloride

o-toluidine

prilocaine

Downstream raw materials:

o-toluidine

Refernces