1-(Hydroxyethyl)-2-(heptadecyl)imidazoline

Base Information

• Chemical Name: 1-(Hydroxyethyl)-2-(heptadecyl)imidazoline
• CAS No.: 95-19-2
• Deprecated CAS: 37349-06-7,50957-78-3,1330-88-7,74551-60-3,53466-91-4,1330-88-7,50957-78-3,74551-60-3
• Molecular Formula: C22H44N2O
• Molecular Weight: 352.604
• European Community (EC) Number: 202-397-8
• NSC Number: 22372
• UNII: POQ94D8LZL
• DSSTox Substance ID: DTXSID9025378
• Nikkaji Number: J22.306I
• Wikidata: Q27286676
• Mol file: 95-19-2.mol

Synonyms:Casamine SH;Fungicide 337;1-(Hydroxyethyl)-2-(heptadecyl)imidazoline;95-19-2;Amine 225;Crodazoline O;2-(2-Heptadecyl-2-imidazolin-1-yl)ethanol;2-Heptadecyl-2-imidazoline-1-ethanol;2-Heptadecyl-3-hydroxyethylimidazoline;Stearyl imidazoline;Fungacide 337;2-Heptadecyl-1-hydroxyethylimidazoline;Stearyl hydroxyethyl imidazoline;1-Hydroxyethyl-2-heptadecyl glyoxalidine;2-Heptadecyl-1-(2-hydroxyethyl)-2-imidazoline;Onyxan HSB;2-Imidazoline, 2-heptadecyl-1-hydroxyethyl-;NSC 22372;1-(2-Hydroxyethyl)-2-heptadecyl-2-imidazoline;CCRIS 1053;2-Imidazoline-1-ethanol, 2-heptadecyl-;1H-Imidazole-1-ethanol, 2-heptadecyl-4,5-dihydro-;EINECS 202-397-8;UNII-POQ94D8LZL;POQ94D8LZL;53466-91-4;2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanol;BRN 0236487;Stearic acid, aminoethylethanolamine amide-imidazoline;1-(beta-Hydroxethyl)-2-heptadecylimidazoline;1-(2-Hydroxyethyl)-2-(heptadecyl)imidazoline;NSC-22372;EPA Pesticide Chemical Code 046611;1-Hydroxyethyl-2-heptadecylglyoxalidine;1-(Hydroxyethyl)-2-heptadecyl-2-imidazoline;1-(.beta.-Hydroxethyl)-2-heptadecylimidazoline;1-(.beta.-Hydroxyethyl)-2-heptadecylimidazoline;5-23-04-00119 (Beilstein Handbook Reference);C22-H44-N2-O;1H-Imidazoleethanol, heptadecyl-4,5-dihydro-;Schercozoline S;Crodazoline S;Miramine GS;Unamine S;Atlasol KAD;Fungicide-337;Caswell No. 474C;Hodag C-100-S;SCHEMBL181446;DTXSID9025378;Heptadecyl hydroxyethyl imidazoline;NSC22372;WLN: T5N CN AUTJ B17 C2Q;LS-1974;2-imidazolina-1-etanol, 2-heptadecil-;1-(hidroxietil)-2-(heptadecil)imidazolina;2-Heptadecyl-1-hydroxyethyl-2-imidazoline;2-Heptadecyl-3-[2-hydroxyethyl]imidazoline;Heptadecyl-4,5-dihydro-1H-imidazoleethanol;1-(beta-Hydroxyethyl)-2-heptadecylimidazoline;1H-Imidazoleethanol, 4,5-dihydro-heptadecyl-;1-(2-hidroxietil)-2-heptadecil 2-imidazolina;STEARYL HYDROXYETHYL IMIDAZOLINE [INCI];HEPTADECYL-3-HYDROXYETHYLIMIDAZOLINE, 2-;1h-imidazol-1-etanol, 2-heptadecil-4,5-dihidro-;2- (2- heptadecyl- 2- imidazolin- 1- yl)ethanol;2-Imidazoline-1-ethanol 2-heptadecyl-(6CI7CI8CI);W-109356;Q27286676;2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethanol;2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethanol #

Chemical Property of 1-(Hydroxyethyl)-2-(heptadecyl)imidazoline

Chemical Property:

• Appearance/Colour: cream-coloured solid
• Vapor Pressure: 4.01E-11mmHg at 25°C
• Melting Point: 64°C
• Refractive Index: 1.501
• Boiling Point: 489 °C at 760 mmHg
• PKA: 15.07±0.10(Predicted)
• Flash Point: 249.5 °C
• PSA: 35.83000
• Density: 0.95 g/cm³
• LogP: 5.32780
• XLogP3: 7.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 18
• Exact Mass: 352.345364031
• Heavy Atom Count: 25
• Complexity: 317

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Imidazoles
• Canonical SMILES: CCCCCCCCCCCCCCCCCC1=NCCN1CCO

Technology Process of 1-(Hydroxyethyl)-2-(heptadecyl)imidazoline

There total 4 articles about 1-(Hydroxyethyl)-2-(heptadecyl)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: 93.0%

2-(2-Aminoethylamino)ethanol (111-41-1) + stearic acid (57-11-4) → 2-heptadecyl-1-(2-hydroxyethyl)-2-imidazoline (95-19-2,53466-91-4)

Guidance literature:

With calcium oxide; at 181 ℃; for 0.15h; microwave irradiation;

DOI:10.1055/s-2003-41410

Reference yield:

stearic acid (57-11-4) → 2-heptadecyl-1-(2-hydroxyethyl)-2-imidazoline (95-19-2,53466-91-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 5,5-dimethyl-1,3-cyclohexadiene / 4 h / 140 °C

2: 4 h / 220 °C

In 5,5-dimethyl-1,3-cyclohexadiene;

DOI:10.1007/s11743-012-1332-5

Reference yield:

[2-(2-hydroxyethylamino)ethyl]heptadecylamide (141-21-9) → 2-heptadecyl-1-(2-hydroxyethyl)-2-imidazoline (95-19-2,53466-91-4)

Guidance literature:

at 220 ℃; for 4h;

DOI:10.1007/s11743-012-1332-5

upstream raw materials:

2-(2-Aminoethylamino)ethanol

stearic acid

[2-(2-hydroxyethylamino)ethyl]heptadecylamide

Downstream raw materials:

C₂₂H₄₄N₂O*CH₂O₃

1,1-bis-(β-hydroxyethyl)-2-heptadecyl-2-imidazolinium chloride

Refernces

• 1、 Martínez-Palou, Rafael,De Paz, Gerardo,Marín-Cruz, Jesús,Zepeda, Luis Gerardo. "Synthesis of Long Chain 2-Alkyl-1-(2-hydroxyethyl)-2-imidazolines under Microwave in Solvent-Free Conditions". . p. 1847 - 1849. Retrieved 2007/10/03.