N-benzylpropan-1-imine

Base Information

• Chemical Name: N-benzylpropan-1-imine
• CAS No.: 63459-05-2
• Molecular Formula: C10H13N
• Molecular Weight: 147.22
• European Community (EC) Number: 613-233-3
• DSSTox Substance ID: DTXSID301303626
• Nikkaji Number: J778.414G
• Mol file: 63459-05-2.mol

Synonyms:N-benzylpropan-1-imine;63459-05-2;N-Propylidenebenzenemethanamine;benzyl-prop-(e)-ylidene-amine;SCHEMBL3390354;JEJVKKAYKKSTRU-DHZHZOJOSA-N;DTXSID301303626

Chemical Property of N-benzylpropan-1-imine

Chemical Property:

• Vapor Pressure: 0.0768mmHg at 25°C
• Boiling Point: 235.4oC at 760 mmHg
• Flash Point: 87.8oC
• PSA: 12.36000
• Density: 0.87g/cm3
• LogP: 2.66740
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 147.104799419
• Heavy Atom Count: 11
• Complexity: 112

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC=NCC1=CC=CC=C1

Technology Process of N-benzylpropan-1-imine

There total 7 articles about N-benzylpropan-1-imine 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: 98.0%

propionaldehyde (123-38-6) + benzylamine (100-46-9) → N-propylidenebenzylamine (63459-05-2)

Guidance literature:

With potassium hydroxide; at 5 - 20 ℃;

DOI:10.1002/chem.201601246

Reference yield: 89.7%

benzyl chloride (100-44-7) + propionaldehyde (123-38-6) → N-propylidenebenzylamine (63459-05-2)

Guidance literature:

propionaldehyde; With tetrabutylammomium bromide; ammonia; In water; at -5 ℃; for 2.5h;

benzyl chloride; In water; at 80 ℃; for 5h; under 1520.1 Torr; Temperature; Pressure; Reagent/catalyst;

Reference yield: 84.0%

propan-1-ol (71-23-8) + benzylamine (100-46-9) → N-propylidenebenzylamine (63459-05-2)

Guidance literature:

With potassium hydroxide; at 30 ℃; for 6h; Green chemistry;

DOI:10.1039/c3ra44625e

upstream raw materials:

propionaldehyde

benzylamine

phenol

Allylbenzylamine

Downstream raw materials:

1-(N-acetyl-N-benzylamino)propene

1-benzyl-3,5-dimethyl-2-phenyl-1,2-dihydro-1,2-λ³-azaphosphinine

1-benzyl-3-ethyl-4-methyl-2-phenyl-2-oxo-1,2,4-azaphospholene

3-Benzylamino-pentanethioic acid S-tert-butyl ester