N-Methyl-2-chloroethyl-2-hydroxyethylamine

Base Information

• Chemical Name: N-Methyl-2-chloroethyl-2-hydroxyethylamine
• CAS No.: 51822-57-2
• Molecular Formula: C5H12 Cl N O
• Molecular Weight: 137.609
• Hs Code.: 2922199090
• DSSTox Substance ID: DTXSID70199778
• Nikkaji Number: J78.144D
• Wikidata: Q83072749
• Mol file: 51822-57-2.mol

Synonyms:N-methyl-2-chloroethyl-2-hydroxyethylamine

Chemical Property of N-Methyl-2-chloroethyl-2-hydroxyethylamine

Chemical Property:

• Vapor Pressure: 0.789mmHg at 25°C
• Boiling Point: 161.4°Cat760mmHg
• Flash Point: 51.4°C
• PSA: 23.47000
• Density: 1.081g/cm³
• LogP: 0.14930
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 137.0607417
• Heavy Atom Count: 8
• Complexity: 51.7

Purity/Quality:

99% ^*data from raw suppliers

2-(2-CHLOROETHYL)METHYLAMINOETHANOLHYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(CCO)CCCl

Technology Process of N-Methyl-2-chloroethyl-2-hydroxyethylamine

There total 1 articles about N-Methyl-2-chloroethyl-2-hydroxyethylamine 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:

water (7732-18-5) + nitrogen mustard (51-75-2) → N-Methyldiethanolamine (105-59-9) + 2‐[(2-chloroethyl)(methyl)amino]ethanol (51822-57-2)

Guidance literature:

wandelt sich bei Raumtemperatur nach mehreren Tagen;

DOI:10.1021/jo01175a016

Reference yield:

2‐[(2-chloroethyl)(methyl)amino]ethanol (51822-57-2) + acetyl chloride (75-36-5) → Acetylcholine mustard (36375-30-1)

Guidance literature:

Reference yield:

2‐[(2-chloroethyl)(methyl)amino]ethanol (51822-57-2) → 1-(2-hydroxy-ethyl)-1-methyl-aziridinium; chloride (64710-70-9)

Guidance literature:

With water;

DOI:10.1021/ja01181a086

upstream raw materials:

water

nitrogen mustard

Downstream raw materials:

1-(2-hydroxy-ethyl)-1-methyl-aziridinium; chloride

Acetylcholine mustard