3-(4-chlorophenyl)-N-phenylprop-2-enamide

Base Information

• Chemical Name: 3-(4-chlorophenyl)-N-phenylprop-2-enamide
• CAS No.: 101681-92-9
• Molecular Formula: C15H12 Cl N O
• Molecular Weight: 257.719
• DSSTox Substance ID: DTXSID40398791
• Mol file: 101681-92-9.mol

Synonyms:3-(4-chlorophenyl)-N-phenylprop-2-enamide;101681-92-9;(E)-3-(4-CHLOROPHENYL)-N-PHENYLACRYLAMIDE;DTXSID40398791;AB07988

Chemical Property of 3-(4-chlorophenyl)-N-phenylprop-2-enamide

Chemical Property:

• PSA: 32.59000
• LogP: 4.64140
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 257.0607417
• Heavy Atom Count: 18
• Complexity: 289

Purity/Quality:

98%min ^*data from raw suppliers

(E)-3-(4-CHLOROPHENYL)-N-PHENYLACRYLAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)Cl

Technology Process of 3-(4-chlorophenyl)-N-phenylprop-2-enamide

There total 13 articles about 3-(4-chlorophenyl)-N-phenylprop-2-enamide 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: 89.0%

3-(4-chlorophenyl)-1-phenylprop-2-en-1-one oxime (61571-80-0) → (E)-3-(4-chlorophenyl)-N-phenylacrylamide (101681-92-9)

Guidance literature:

With formic acid; hydroxylamine hydrochloride; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In acetonitrile; at 80 ℃; for 12h; Schlenk technique;

DOI:10.1039/c3ob42444h

Reference yield: 84.0%

C15H12ClNO (1566419-05-3) → (E)-3-(4-chlorophenyl)-N-phenylacrylamide (101681-92-9)

Guidance literature:

With formic acid; In acetonitrile; at 80 ℃;

DOI:10.1039/c3ob42444h

Reference yield: 83.0%

2-benzenesulfonyl-3-(4-chloro-phenyl)-N-phenyl-acrylamide → (E)-3-(4-chlorophenyl)-N-phenylacrylamide (101681-92-9)

Guidance literature:

With samarium; In ethanol; acetic acid; at 20 ℃; for 3h;

upstream raw materials:

aniline

p-chlorocinnamoyl chloride

4-chlorobenzaldehyde

Acetanilid

Refernces

• 1、 Chen, Bo,Wu, Xiao-Feng. "Palladium-catalyzed carbonylative synthesis of α,β-unsaturated amides from aryl azides and alkenylaluminum reagent". . p. 160 - 163. Retrieved 2020/02/11.
• 2、 Goyal, Akhil,Sharma, Sunita,Gaba, Jyoti,Kaur, Harleen. "Green synthesis of isoxazoline derivatives using microwave irradiation and their antifungal activity". . p. 2169 - 2172. Retrieved 2016/07/19.