Ethyl 2-butyl-2-carbamoylhexanoate

Base Information

• Chemical Name: Ethyl 2-butyl-2-carbamoylhexanoate
• CAS No.: 92671-73-3
• Molecular Formula: C₁₃H₂₅NO₃
• Molecular Weight: 243.346
• NSC Number: 166297
• DSSTox Substance ID: DTXSID10304566
• Wikidata: Q82050571
• Mol file: 92671-73-3.mol

Synonyms:92671-73-3;ethyl 2-butyl-2-carbamoylhexanoate;NSC166297;ETHYL 2-BUTYL-2-CARBAMOYL-HEXANOATE;DTXSID10304566;AKOS024332583;NSC-166297

Chemical Property of Ethyl 2-butyl-2-carbamoylhexanoate

Chemical Property:

• Vapor Pressure: 1.63E-05mmHg at 25°C
• Boiling Point: 364.9°C at 760 mmHg
• Flash Point: 131.8°C
• Density: 0.983g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 243.18344366
• Heavy Atom Count: 17
• Complexity: 243

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CCCC)(C(=O)N)C(=O)OCC

Technology Process of Ethyl 2-butyl-2-carbamoylhexanoate

There total 2 articles about Ethyl 2-butyl-2-carbamoylhexanoate 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:

ethyl 2,2-dibutyl-2-cyanoacetate (67105-41-3) → 2,2-dibutyl-malonamic acid ethyl ester (92671-73-3)

Guidance literature:

With sulfuric acid;

DOI:10.1002/hlca.19590420709

Reference yield:

→ dibutyl-malonic acid monoamide (100050-33-7) + 2,2-dibutyl-malonamic acid ethyl ester (92671-73-3)

Guidance literature:

With sulfuric acid;

upstream raw materials:

ethyl 2,2-dibutyl-2-cyanoacetate