2-Phenyl-2-imidazoline

Base Information

• Chemical Name: 2-Phenyl-2-imidazoline
• CAS No.: 936-49-2
• Deprecated CAS: 170013-98-6,54391-81-0,54391-81-0
• Molecular Formula: C9H10 N2
• Molecular Weight: 146.192
• Hs Code.: 29332900
• European Community (EC) Number: 213-313-4
• NSC Number: 54747
• DSSTox Substance ID: DTXSID5061322
• Nikkaji Number: J103.142B
• Wikidata: Q63392122
• Pharos Ligand ID: FB4D7ARY324Y
• ChEMBL ID: CHEMBL274548
• Mol file: 936-49-2.mol

Synonyms:2-phenyl-2-imidazoline

Chemical Property of 2-Phenyl-2-imidazoline

Chemical Property:

• Appearance/Colour: white powder
• Vapor Pressure: 0.0243mmHg at 25°C
• Melting Point: 96 - 101C
• Refractive Index: 1.5600 (estimate)
• Boiling Point: 248.4 °C at 760 mmHg
• PKA: 9.95±0.40(Predicted)
• Flash Point: 201 ºC
• PSA: 24.39000
• Density: 1.12 g/cm³
• LogP: 0.80080
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Water Solubility.: SOLUBLE
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 146.084398327
• Heavy Atom Count: 11
• Complexity: 157

Purity/Quality:

99.9% ^*data from raw suppliers

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

Safty Information:

• Hazard Codes: C,Xi,N,Xn
• Statements: 22-34-36/37/38-50/53-41-38
• Safety Statements: 26-36/37/39-45-37/39-61-60-39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CN=C(N1)C2=CC=CC=C2
• Description: 2-Phenyl-2-imidazoline is white crystal and can be used as epoxy resin powder , pharmaceutical raw material or used in organic synthesis.
• Uses: Catalyst for: N-arylation of indolesEpoxy-carbonyl reactions

Technology Process of 2-Phenyl-2-imidazoline

There total 79 articles about 2-Phenyl-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: 100.0%

benzaldehyde (100-52-7) + ethylenediamine (107-15-3,85404-18-8) → 2-phenyl-2-imidazoline (936-49-2)

Guidance literature:

With iodine; potassium carbonate; In tert-butyl alcohol; at 70 ℃; for 3h;

DOI:10.1016/j.tet.2006.11.077

Reference yield: 99.0%

ethylenediamine (107-15-3,85404-18-8) + benzyl alcohol (100-51-6,185532-71-2) → 2-phenyl-2-imidazoline (936-49-2)

Guidance literature:

benzyl alcohol; With iodine; potassium carbonate; In tert-butyl alcohol; at 70 ℃; for 8h;

ethylenediamine; In tert-butyl alcohol; at 70 ℃; for 2h;

DOI:10.1016/j.tet.2006.11.077

Reference yield: 95.0%

benzonitrile (100-47-0) + ethylenediamine (107-15-3,85404-18-8) → 2-phenyl-2-imidazoline (936-49-2)

Guidance literature:

With Cu(II) immobilized on Fe₃O₄-agarose nanomagnetic catalyst functionalized with ethanolamine phosphate-salicylaldehyde Schiff base; at 100 ℃; for 3h; Temperature; Reagent/catalyst; Catalytic behavior;

DOI:10.3906/kim-1704-53

upstream raw materials:

N-(2-amino-ethyl)-benzamide

N,N'-ethanediyl-bis-benzamide

ethanolamine

benzonitrile

Downstream raw materials:

2-acetoxy-1,3-diacetyl-2-phenyl-imidazolidine

1-benzoyl-2-phenyl-4,5-dihydro-1H-imidazole

2-phenyl-4,5-dihydro-imidazole-1-carboxylic acid anilide

2-phenyl-imidazolidine