2-Propyl-2-imidazoline

Base Information

• Chemical Name: 2-Propyl-2-imidazoline
• CAS No.: 15450-05-2
• Molecular Formula: C6H12 N2
• Molecular Weight: 112.175
• Hs Code.: 2933290090
• European Community (EC) Number: 679-675-4
• DSSTox Substance ID: DTXSID40165647
• Nikkaji Number: J187.087D
• Wikidata: Q83034887
• Mol file: 15450-05-2.mol

Synonyms:2-Propyl-2-imidazoline;2-propyl-4,5-dihydro-1H-imidazole;15450-05-2;2-N-propyl-2-imidazoline;Propylglyoxalidine;2-IMIDAZOLINE, 2-PROPYL-;1H-Imidazole, 4,5-dihydro-2-propyl-;BRN 0106021;5-23-03-00450 (Beilstein Handbook Reference);2-n-Propyl-imidazolin;SCHEMBL1742033;LFCYHAXVBWPGQR-UHFFFAOYSA-;DTXSID40165647;MFCD00191487;AKOS006227980;AS-75588;LS-79678;CS-0119918;FT-0691848;P1164;D92082;A921628

Chemical Property of 2-Propyl-2-imidazoline

Chemical Property:

• Vapor Pressure: 0.121mmHg at 25°C
• Melting Point: 42 °C
• Boiling Point: 140 °C / 23mmHg
• Flash Point: 91°C
• PSA: 24.39000
• Density: 1.03g/cm³
• LogP: 0.55260
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 112.100048391
• Heavy Atom Count: 8
• Complexity: 96.7

Purity/Quality:

98% ^*data from raw suppliers

2-Propyl-2-imidazoline ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=NCCN1

Technology Process of 2-Propyl-2-imidazoline

There total 6 articles about 2-Propyl-2-imidazoline 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: 70.0%

ethylenediamine (107-15-3,85404-18-8) + butyric acid (107-92-6) → 2-Propyl-4,5-dihydro-1H-imidazol (15450-05-2)

Guidance literature:

With iron oxide; In water; benzene; at 80 ℃; for 4h;

DOI:10.1134/S1070363216020122

Reference yield:

N,N'-ethanediyl-bis-butyramide (925-49-5) → 2-Propyl-4,5-dihydro-1H-imidazol (15450-05-2)

Guidance literature:

With magnesium; at 330 ℃;

DOI:10.1021/ja01315a030

Reference yield:

1-ethoxy-1-butyne (14272-91-4) + ethylenediamine (107-15-3,85404-18-8) → 2-Propyl-4,5-dihydro-1H-imidazol (15450-05-2)

Guidance literature:

With mercury(II) oxide;

upstream raw materials:

imidazolidone

butyric acid

N,N'-ethanediyl-bis-butyramide

1-ethoxy-1-butyne

Downstream raw materials:

2-propylimidazole