N-(1-aminopropan-2-yl)aniline

Base Information

• Chemical Name: N-(1-aminopropan-2-yl)aniline
• CAS No.: 42164-53-4
• Molecular Formula: C₉H₁₄N₂
• Molecular Weight: 150.224
• European Community (EC) Number: 888-837-5
• Mol file: 42164-53-4.mol

Synonyms:N-(1-aminopropan-2-yl)aniline;42164-53-4;2-N-phenylpropane-1,2-diamine;N2-phenylpropane-1,2-diamine;SCHEMBL3110474;AKOS006312994;EN300-95958;Z1198235985

Chemical Property of N-(1-aminopropan-2-yl)aniline

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 150.115698455
• Heavy Atom Count: 11
• Complexity: 97.7

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(CN)NC1=CC=CC=C1

Technology Process of N-(1-aminopropan-2-yl)aniline

There total 12 articles about N-(1-aminopropan-2-yl)aniline 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%

N-(2-Anilinopropyl)-acetamide (78286-59-6) → N2-phenylpropane-1,2-diamine (42164-53-4)

Guidance literature:

With hydrogenchloride; In ethanol; for 24h; Heating;

DOI:10.1055/s-1981-29383

Reference yield:

iodobenzene (591-50-4) + 1,2-diaminopropan (78-90-0,10424-38-1) → N2-phenylpropane-1,2-diamine (42164-53-4) + N1-phenylpropane-1,2-diamine (6499-72-5,62733-56-6)

Guidance literature:

With chitosan Cu²⁺ complex; In acetonitrile; for 5h; Overall yield = 92 %; Reflux; Green chemistry;

DOI:10.1016/j.tetlet.2014.11.120

Reference yield:

bromobenzene (108-86-1,52753-63-6) + 1,2-diaminopropan (78-90-0,10424-38-1) → N2-phenylpropane-1,2-diamine (42164-53-4) + N1-phenylpropane-1,2-diamine (6499-72-5,62733-56-6)

Guidance literature:

With chitosan Cu²⁺ complex; In acetonitrile; for 6h; Overall yield = 90 %; Reflux; Green chemistry;

DOI:10.1016/j.tetlet.2014.11.120

upstream raw materials:

2-anilinopropionitrile

N-(1-nitropropan-2-yl)aniline

N-(2-Anilinopropyl)-acetamide

aniline

Downstream raw materials:

(+)-N²-phenyl-propane-1,2-diamine

(-)-N²-phenyl-propane-1,2-diamine