N-Styrylbenzamide

Base Information

• Chemical Name: N-Styrylbenzamide
• CAS No.: 49747-42-4
• Molecular Formula: C15H13NO
• Molecular Weight: 223.274
• NSC Number: 255223
• Nikkaji Number: J1.322.235E,J2.393.873A
• ChEMBL ID: CHEMBL1362810
• Mol file: 49747-42-4.mol

Synonyms:N-Styrylbenzamide;CMLDBU00003449;49747-42-4;N-[(E)-2-phenylethenyl]benzamide;NSC255223;N-((E)-Styryl)benzamide;MLS001242876;CHEMBL1362810;HMS2205N19;NSC-255223;SMR000841377

Chemical Property of N-Styrylbenzamide

Chemical Property:

• Vapor Pressure: 1.03E-07mmHg at 25°C
• Boiling Point: 433.4°Cat760mmHg
• Flash Point: 260.7°C
• Density: 1.123g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 223.099714038
• Heavy Atom Count: 17
• Complexity: 260

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CNC(=O)C2=CC=CC=C2
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/NC(=O)C2=CC=CC=C2

Technology Process of N-Styrylbenzamide

There total 10 articles about N-Styrylbenzamide 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: 71.0%

chalcone oxime (6502-38-1) → N-(2-phenyl-1-vinyl)benzamide (49747-42-4)

Guidance literature:

chalcone oxime; With Nonafluorobutanesulfonyl fluoride; In chloroform; at 0 ℃; for 0.166667h; Inert atmosphere;

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In chloroform; at 0 ℃; Inert atmosphere;

DOI:10.1016/j.tetlet.2014.10.154

Reference yield:

bromostyrene (103-64-0,1340-14-3) + benzamide (55-21-0,27208-38-4) → N-(2-phenyl-1-vinyl)benzamide (49747-42-4)

Guidance literature:

With 4-methylisopropylbenzene; copper (I) acetate; potassium carbonate;

Reference yield:

1-benzoyl-1H-benzotriazole (4231-62-3) + (2-nitroethenyl)benzene (102-96-5) → N-(2-phenyl-1-vinyl)benzamide (49747-42-4)

Guidance literature:

With chloro-trimethyl-silane; (1,2-dimethoxyethane)dichloronickel(II); bathophenanthroline; zinc; In 1,4-dioxane; at 100 ℃; for 15h; Schlenk technique; Sealed tube; Inert atmosphere;

DOI:10.1021/acs.orglett.1c03535

upstream raw materials:

bromostyrene

benzamide

2-Benzamido-1-phenylethyl acetate

2-Benzoylamino-1-phenyl-1-carboxy-aethylen

Downstream raw materials:

1-phenylisoquinoline

(2-amino-1-phenylethyl)phosphonic acid

Refernces

• 1、 Yan, Zhaohua,Xu, Yun,Tian, Weisheng. "A new and concise way to enamides by fluoroalkanosulfonyl fluoride mediated Beckmann rearrangement of α,β-unsaturated ketoximes". supporting information. p. 7186 - 7189. Retrieved 2015/02/02.
• 2、 Estevez, J.C.,Villaverde, M.C.,Estevez, R.J.,Seijas, J.A.,Castedo, L.. "A New Simple Route to Styrylamides". . p. 503 - 507. Retrieved 2007/10/02.