1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one

Base Information

• Chemical Name: 1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one
• CAS No.: 876048-06-5
• Molecular Formula: C₁₅H₁₂BrNO
• Molecular Weight: 302.17
• DSSTox Substance ID: DTXSID10695648
• Mol file: 876048-06-5.mol

Synonyms:1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one;876048-06-5;DTXSID10695648

Chemical Property of 1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one

Chemical Property:

• PSA: 43.09000
• LogP: 4.50860
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 301.01023
• Heavy Atom Count: 18
• Complexity: 308

Purity/Quality:

(2E)-1-(4-AMINOPHENYL)-3-(3-BROMOPHENYL)-PROP-2-EN-1-ONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)Br)C=CC(=O)C2=CC=C(C=C2)N

Technology Process of 1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one

There total 6 articles about 1-(4-Aminophenyl)-3-(3-bromophenyl)prop-2-en-1-one 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: 81.0%

m-bromobenzoic aldehyde (3132-99-8) + p-aminobenzophenone (99-92-3) → (E)-1-(4'-aminophenyl)-3-(3-bromophenyl)-2-propen-1-one (876048-06-5)

Guidance literature:

With potassium hydroxide; In methanol; water; at 20 ℃;

Reference yield:

m-bromobenzoic aldehyde (3132-99-8) + p-aminobenzophenone (99-92-3) → 3-bromo-4'-amino-chalcone (118004-12-9,876048-06-5)

Guidance literature:

DOI:10.1016/j.bmcl.2008.12.049

Reference yield:

BF4(1-)*C34H29BrN3O2(1+) → 3-bromo-4'-amino-chalcone (118004-12-9,876048-06-5)

Guidance literature:

BF₄^(1-)*C₃₄H₂₉BrN₃O₂⁽¹⁺⁾; With trifluoroacetic acid; In methanol; at 20 ℃;

With sodium hydroxide; In water; Saturated solution;

upstream raw materials:

m-bromobenzoic aldehyde

N-(4-Hydroxybenzyliden)-4-acetylanilin

p-aminobenzophenone

Downstream raw materials:

C₁₅H₁₆BrN