2-Propenamide, 3-phenyl-

Base Information

• Chemical Name: 2-Propenamide, 3-phenyl-
• CAS No.: 621-79-4
• Molecular Formula: C9H9NO
• Molecular Weight: 147.177
• Hs Code.: 29242990
• Wikidata: Q204165
• Mol file: 621-79-4.mol

Synonyms:Cinnamic Acid Amide;SCHEMBL159753;SCHEMBL1821026;AKOS022259532;SY006676;FT-0623828;FT-0647828;Q204165;21-79-4

Chemical Property of 2-Propenamide, 3-phenyl-

Chemical Property:

• Appearance/Colour: off-white to beige crystalline powder
• Vapor Pressure: 4.44E-05mmHg at 25°C
• Melting Point: 148-150 °C(lit.)
• Refractive Index: 1.613
• Boiling Point: 350.3 °C at 760 mmHg
• PKA: 15?+-.0.50(Predicted)
• Flash Point: 165.6 °C
• PSA: 43.09000
• Density: 1.121 g/cm³
• LogP: 1.88540
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 147.068413911
• Heavy Atom Count: 11
• Complexity: 157

Purity/Quality:

99%min ^*data from raw suppliers

Cinnamamide, predominantly trans 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CC(=O)N
• Uses: Cinnamamide, a non-lethal repellent, deters feeding by a wide range of avian species.

Technology Process of 2-Propenamide, 3-phenyl-

There total 186 articles about 2-Propenamide, 3-phenyl- 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%

Cinnamoyl chloride (102-92-1,17082-09-6) → cinnamamide (621-79-4,22031-64-7)

Guidance literature:

With ammonium hydroxide; In tert-butyl methyl ether; at 0 - 20 ℃;

DOI:10.1002/adsc.202100198

Reference yield: 100.0%

cinnamic nitrile (1885-38-7) → cinnamamide (621-79-4,22031-64-7)

Guidance literature:

With sodium hydroxide; dihydrogen peroxide; dimethyl sulfoxide; In methanol; water; at 50 ℃; for 1h;

DOI:10.1246/bcsj.54.793

Reference yield: 99.3%

iodobenzene (591-50-4) + 2-propenamide (79-06-1,12624-24-7,25038-45-3,27754-57-0,33338-03-3,39387-77-4,68247-81-4,9082-06-8,79079-15-5) → cinnamamide (621-79-4,22031-64-7)

Guidance literature:

With triethylamine; {[Pd(η⁵-C5H5)Fe(η⁵-C5H3)C(CH3)=N(C6H4CH3-4)](μ-I)}2; In 1,4-dioxane; at 100 ℃; for 15h;

DOI:10.1016/S0022-328X(01)00967-6

upstream raw materials:

acetamide

ethyl 3-phenyl-2-propenoate

diethyl ether

cinnamic nitrile

Downstream raw materials:

cinnamonitrile

3-phenylglutaric acid

2,6-dioxo-4-phenyl-piperidine-3-carbonitrile

2-styrylbenzo[d]oxazole

Refernces

• 1、 Schmidt-R?ntsch, Till,Verplancke, Hendrik,Lienert, Jonas N.,Demeshko, Serhiy,Otte, Matthias,Van Trieste, Gerard P.,Reid, Kaleb A.,Reibenspies, Joseph H.,Powers, David C.,Holthausen, Max C.,Schneider, Sven. "Nitrogen Atom Transfer Catalysis by Metallonitrene C?H Insertion: Photocatalytic Amidation of Aldehydes". . . Retrieved 2022/01/20.
• 2、 Ye, Runyou,Zhu, Maoshuai,Yan, Xufei,Long, Yang,Xia, Ying,Zhou, Xiangge. "Pd(II)-Catalyzed CC Bond Cleavage by a Formal Group-Exchange Reaction". . p. 8678 - 8683. Retrieved 2021/07/26.