2-Phenylprop-2-en-1-amine hydrochloride

Base Information

• Chemical Name: 2-Phenylprop-2-en-1-amine hydrochloride
• CAS No.: 56132-76-4
• Molecular Formula: C9H11N.ClH
• Molecular Weight: 169.65100
• European Community (EC) Number: 970-301-8
• ChEMBL ID: CHEMBL544745
• Mol file: 56132-76-4.mol

Synonyms:2-phenylprop-2-en-1-amine hydrochloride;56132-76-4;2-phenylprop-2-en-1-amine;hydrochloride;2-Phenyl-Allylamine HCl;CHEMBL544745;SCHEMBL8011176;AKOS030757221;2-phenylprop-2-en-1-aminehydrochloride;EN300-43424;Z2065464323

Chemical Property of 2-Phenylprop-2-en-1-amine hydrochloride

Chemical Property:

• Melting Point: 140-142 °C
• PSA: 26.02000
• LogP: 3.16080
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 169.0658271
• Heavy Atom Count: 11
• Complexity: 112

Purity/Quality:

99% ^*data from raw suppliers

2-phenylprop-2-en-1-aminehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C(CN)C1=CC=CC=C1.Cl

Technology Process of 2-Phenylprop-2-en-1-amine hydrochloride

There total 3 articles about 2-Phenylprop-2-en-1-amine hydrochloride 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: 70.0%

N-(2-phenyl-2-propenyl)phthalimide (16307-59-8) → chlorhydrate de l'amino-3 phenyl-2 propene (56132-76-4)

Guidance literature:

With hydrogenchloride; hydrazine; In methanol; water; 1.) reflux, 1 h, 2.) reflux, 30 min, 3.) -10 deg C;

DOI:10.1021/jo00135a008

Reference yield:

N-Methoxycarbonyl-2-phenylallylamine (85278-15-5) → 2-phenylallylamine (28144-67-4) + chlorhydrate de l'amino-3 phenyl-2 propene (56132-76-4)

Guidance literature:

With trimethylsilyl iodide; In methanol; chloroform;

Reference yield:

3-bromo-2-phenylprop-1-ene (3360-54-1) → chlorhydrate de l'amino-3 phenyl-2 propene (56132-76-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 70 percent / CHCl₃ / 1 h

2: 70 percent / 1.) hydrazine, 2.) HCl / methanol; H₂O / 1.) reflux, 1 h, 2.) reflux, 30 min, 3.) -10 deg C

With hydrogenchloride; hydrazine; In methanol; chloroform; water;

DOI:10.1021/jo00135a008

upstream raw materials:

N-(2-phenyl-2-propenyl)phthalimide

3-bromo-2-phenylprop-1-ene

N-Methoxycarbonyl-2-phenylallylamine

Downstream raw materials:

S-β-methylphenethylamine hydrochloride

(R)-β-methylphenethylamine hydrochloride