Propyl aminoacetate HCl

Base Information

• Chemical Name: Propyl aminoacetate HCl
• CAS No.: 13049-01-9
• Molecular Formula: C5H12ClNO2
• Molecular Weight: 153.609
• Hs Code.: 2922499990
• Mol file: 13049-01-9.mol

Synonyms:Propyl aminoacetate HCl;EINECS 235-925-0;(2-oxo-2-propoxyethyl)ammonium chloride;FT-0626772;(2-oxidanylidene-2-propoxy-ethyl)azanium chloride;A806092

Chemical Property of Propyl aminoacetate HCl

Chemical Property:

• Vapor Pressure: 7.86mmHg at 25°C
• Melting Point: 78-80 °C
• Refractive Index: 1.429
• Boiling Point: 135.1 °C at 760 mmHg
• Flash Point: 10.6 °C
• PSA: 52.32000
• Density: 0.99g/cm³
• LogP: 1.40060
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 153.0556563
• Heavy Atom Count: 9
• Complexity: 72.8

Purity/Quality:

99% ^*data from raw suppliers

Glycine n-propyl ester hydrochloride ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC(=O)C[NH3+].[Cl-]

Technology Process of Propyl aminoacetate HCl

There total 2 articles about Propyl aminoacetate HCl 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: 98.0%

propan-1-ol (71-23-8) + 2-aminoethanoic acid hydrochloride (6000-43-7) → glycine 1-propyl ester hydrochloride (13049-01-9)

Guidance literature:

With thionyl chloride; at 20 - 70 ℃; for 15h; Inert atmosphere;

Reference yield:

propan-1-ol (71-23-8) + glycine (56-40-6,18875-39-3,25718-94-9) → glycine 1-propyl ester hydrochloride (13049-01-9)

Guidance literature:

propan-1-ol; With thionyl chloride; at -10 - 0 ℃; for 1h;

glycine; at -10 ℃; for 7h; Reflux;

Reference yield: 94.3%

glycine 1-propyl ester hydrochloride (13049-01-9) + Cinnamic acid (621-82-9) → propyl N-[3-phenyl-1-oxo-2-propen-1-yl] glycinate (294177-64-3)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In N,N-dimethyl-formamide; at 0 - 18 ℃; for 18h;

DOI:10.1016/j.foodchem.2012.03.021

upstream raw materials:

propan-1-ol

2-aminoethanoic acid hydrochloride

glycine

Downstream raw materials:

propyl N-[3-phenyl-1-oxo-2-propen-1-yl] glycinate

propyl 2-(diphenylmethyleneamino)acetate

propyl N-benzoyl-glycinate

Refernces

• 1、 -. "Antibacterial preservative is sorbic acid amino ester derivative and its preparation method". Paragraph 0042. . Retrieved 2016/11/02.