N-(2-Carboxyethyl)putrescine

Base Information

• Chemical Name: N-(2-Carboxyethyl)putrescine
• CAS No.: 25887-39-2
• Molecular Formula: C₇H₁₆N₂O₂
• Molecular Weight: 160.216
• Hs Code.: 2922499990
• Wikidata: Q27161672
• Mol file: 25887-39-2.mol

Synonyms:N-(2-Carboxyethyl)putrescine;N-(4-aminobutyl)-beta-alanine;CHEBI:89478;Q27161672

Chemical Property of N-(2-Carboxyethyl)putrescine

Chemical Property:

• Vapor Pressure: 8.9E-05mmHg at 25°C
• Boiling Point: 316.2°C at 760 mmHg
• Flash Point: 145°C
• PSA: 75.35000
• Density: 1.059g/cm³
• LogP: 0.88080
• XLogP3: -3.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 161.129002789
• Heavy Atom Count: 11
• Complexity: 107

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCNCCC(=O)O)C[NH3+]

Technology Process of N-(2-Carboxyethyl)putrescine

There total 4 articles about N-(2-Carboxyethyl)putrescine 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:

3-[Acetyl-(4-acetylamino-butyl)-amino]-propionic acid (70350-74-2) → N-(2-Carboxyethyl)-putrescin (25887-39-2)

Guidance literature:

With hydrogenchloride;

Reference yield:

N-(4-Acetylamino-butyl)-N-(2-cyano-ethyl)-acetamide (70350-72-0) → N-(2-Carboxyethyl)-putrescin (25887-39-2)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) HCl, EtOH, (ii) aq. HCl, (iii) ion-exchange resin - form>

2: aq. HCl

With hydrogenchloride;

Reference yield:

N-(4-acetylamino-butyl)-β-alanine nitrile; hydrochloride (70350-71-9) → N-(2-Carboxyethyl)-putrescin (25887-39-2)

Guidance literature:

Multi-step reaction with 3 steps

1: (i) ion-exchange resin - form>, H₂O, (ii) /BRN= 385737/, EtOH

2: (i) HCl, EtOH, (ii) aq. HCl, (iii) ion-exchange resin - form>

3: aq. HCl

With hydrogenchloride;

upstream raw materials:

3-[Acetyl-(4-acetylamino-butyl)-amino]-propionic acid

N-(4-Acetylamino-butyl)-N-(2-cyano-ethyl)-acetamide

N-(4-acetylamino-butyl)-β-alanine nitrile; hydrochloride

Refernces