Ethanamine, N-(phenylmethylene)-

Base Information

• Chemical Name: Ethanamine, N-(phenylmethylene)-
• CAS No.: 6852-54-6
• Molecular Formula: C9H11 N
• Molecular Weight: 133.193
• Hs Code.: 2925290090
• European Community (EC) Number: 229-948-5
• DSSTox Substance ID: DTXSID7064491
• Nikkaji Number: J265.932H,J2.640.115A
• Mol file: 6852-54-6.mol

Synonyms:6852-54-6;N-Benzylideneethylamine;Benzylidene(ethyl)amine;N-ethyl-1-phenylmethanimine;Ethanamine, N-(phenylmethylene)-;N-(phenylmethylidene)ethanamine;ETHYL(PHENYLMETHYLIDENE)AMINE;EINECS 229-948-5;AI3-27077;benzylideneaminoethane;N-Ethylbenzenemethanimine;N-benzyl-idene-ethylamine;N-ethyl-1-phenyl-methanimine;SCHEMBL1101650;DTXSID7064491;SCHEMBL19003736;N-Benzylideneethylamine, >=97%;N-[(E)-phenylmethylidene]ethanamine;AKOS015917281;FT-0654102;A836174;[(Ethane-1-ium)-1-ylidene]amino(phenyl)methaneanion

Chemical Property of Ethanamine, N-(phenylmethylene)-

Chemical Property:

• Vapor Pressure: 0.359mmHg at 25°C
• Melting Point: 195 °C
• Refractive Index: 1.5378 (estimate)
• Boiling Point: 205.41°C at 760 mmHg
• PKA: 5.44±0.50(Predicted)
• Flash Point: 69.456°C
• PSA: 12.36000
• Density: 0.873g/cm³
• LogP: 2.12540
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 133.089149355
• Heavy Atom Count: 10
• Complexity: 101

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-Benzylideneethylamine ≥97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 1853511
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCN=CC1=CC=CC=C1

Technology Process of Ethanamine, N-(phenylmethylene)-

There total 29 articles about Ethanamine, N-(phenylmethylene)- 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: 95.3%

benzylamine (100-46-9) → N-(benzylidene)ethylamine (6852-54-6)

Guidance literature:

With ammonium hydroxide; oxygen; In 1,4-dioxane; at 99.84 ℃; for 8h; under 4560.31 Torr; Reagent/catalyst; Temperature; Catalytic behavior; Autoclave;

DOI:10.1016/j.catcom.2013.03.020

Reference yield: 95.0%

N-ethylbenzylamine (14321-27-8) → N-(benzylidene)ethylamine (6852-54-6)

Guidance literature:

With iodosylbenzene; In dichloromethane; for 2h; Ambient temperature;

Reference yield: 90.0%

N-ethylbenzylamine (14321-27-8) → N-(benzylidene)ethylamine (6852-54-6) + N-benzylidene benzylamine (780-25-6) + benzaldehyde (100-52-7)

Guidance literature:

With oxygen; In para-xylene; at 110 ℃; for 1h;

DOI:10.1039/c4cc00024b

upstream raw materials:

benzaldehyde

ethylamine

N-ethylbenzylamine

4-nitrobenzaldehdye

Downstream raw materials:

2-ethoxycarbonylmethyl-2-hydroxy-4-oxo-6-phenyl-cyclohexane-1,3,5-tricarboxylic acid triethyl ester

1-ethyl-4-hydroxy-2,6-diphenyl-1,2,3,6-tetrahydro-pyridine-3,5-dicarboxylic acid diethyl ester

N-ethyl-5-methyl-2,4-dinitro-aniline

3-ethyl-2-phenyl-thiazolidin-4-one