2,2-Dichloro-N-hexylethanimidic acid

Base Information

• Chemical Name: 2,2-Dichloro-N-hexylethanimidic acid
• CAS No.: 5326-95-4
• Molecular Formula: C₈H₁₅Cl₂NO
• Molecular Weight: 212.119
• NSC Number: 4089
• DSSTox Substance ID: DTXSID90967835
• Wikidata: Q82950472
• Mol file: 5326-95-4.mol

Synonyms:5326-95-4;NSC4089;2,2-Dichloro-N-hexylethanimidic acid;DTXSID90967835;NSC-4089;AKOS003864629

Chemical Property of 2,2-Dichloro-N-hexylethanimidic acid

Chemical Property:

• Vapor Pressure: 0.000728mmHg at 25°C
• Refractive Index: 1.464
• Boiling Point: 307.4 °C at 760 mmHg
• Flash Point: 139.7 °C
• Density: 1.118 g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 211.0530695
• Heavy Atom Count: 12
• Complexity: 128

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCNC(=O)C(Cl)Cl

Technology Process of 2,2-Dichloro-N-hexylethanimidic acid

There total 1 articles about 2,2-Dichloro-N-hexylethanimidic acid 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:

dichloroacethyl chloride (79-36-7) + hexan-1-amine (111-26-2) → dichloro-acetic acid hexylamide (5326-95-4)

Guidance literature:

With 1,2-dichloro-ethane; at -20 - 10 ℃;

DOI:10.1021/ja01192a028

upstream raw materials:

dichloroacethyl chloride

hexan-1-amine