N-tert-Octylacrylamide

Base Information

• Chemical Name: N-tert-Octylacrylamide
• CAS No.: 4223-03-4
• Deprecated CAS: 174408-68-5,174408-72-1,80874-11-9,174408-72-1,80874-11-9
• Molecular Formula: C11H21NO
• Molecular Weight: 183.294
• Hs Code.: 2924199090
• European Community (EC) Number: 224-169-7
• NSC Number: 9035
• UNII: 0U7G677BFR
• DSSTox Substance ID: DTXSID5027564
• Nikkaji Number: J205.646A
• Wikidata: Q27237258
• Mol file: 4223-03-4.mol

Synonyms:N-tert-Octylacrylamide;4223-03-4;N-(2,4,4-trimethylpentan-2-yl)prop-2-enamide;tert-Octylacrylamide;N-(1,1,3,3-Tetramethylbutyl)acrylamide;N-(2,4,4-Trimethylpentan-2-yl)acrylamide;2-Propenamide, N-(1,1,3,3-tetramethylbutyl)-;0U7G677BFR;Acrylamide, N-(1,1,3,3-tetramethylbutyl)-;NSC-9035;N-(1,1,3,3-Tetramethylbutyl)-2-propenamide;NSC9035;N-t-octylacrylamide;N-tertoctylacrylamide;UNII-0U7G677BFR;SCHEMBL36167;DTXSID5027564;MFCD00048259;Acrylamide,1,3,3-tetramethylbutyl)-;AKOS009891904;N-(1,3,3-Tetramethylbutyl)acrylamide;2-Propenamide,1,3,3-tetramethylbutyl)-;AS-57769;ACRYLAMIDE, N-(5,5-DIMETHYLHEXYL)-;FT-0629063;N-(2,4,4-Trimethylpentane-2-yl)acrylamide;T3861;2-Propenamide, N-1,1,3,3-tetramethylbutyl-;EC 224-169-7;F21302;N-(1,1,3,3-Tetramethylbutyl)acrylamide, AldrichCPR;Q27237258;N-(1,1,3,3-Tetramethylbutyl)acrylamide (stabilized with MEHQ);N-(1,1,3,3-Tetramethylbutyl)acrylamide, >/=95%,stabilized with MEHQ;S-[2-(diethylamino)ethyl]alpha-phenylbenzeneethanethioatehydrochloride

Chemical Property of N-tert-Octylacrylamide

Chemical Property:

• Vapor Pressure: 0.00218mmHg at 25°C
• Melting Point: 63-64 °C
• Refractive Index: 1.445
• Boiling Point: 289.6 °C at 760 mmHg
• PKA: 15.10±0.46(Predicted)
• Flash Point: 171.1 °C
• PSA: 29.10000
• Density: 0.867 g/cm³
• LogP: 2.89430
• Solubility.: soluble in Methanol
• Water Solubility.: 1.01g/L at 20℃
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 183.162314293
• Heavy Atom Count: 13
• Complexity: 199

Purity/Quality:

99.9% ^*data from raw suppliers

N-(1,1,3,3-Tetramethylbutyl)acrylamide (stabilized with MEHQ) ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)CC(C)(C)NC(=O)C=C

Technology Process of N-tert-Octylacrylamide

There total 2 articles about N-tert-Octylacrylamide 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:

β-diethylamino-N-tert-octylpropionamide (131516-80-8) → tertiary-octyl acrylamide (4223-03-4)

Guidance literature:

With 4,4'-butylidenebis(6-tert-butyl-m-cresol); In ethylene glycol; at 150 ℃; for 4h; under 52.5053 Torr; Inert atmosphere;

Reference yield:

2,4,4-trimethyl-1-pentene (107-39-1) + acrylonitrile (107-13-1,25014-41-9) → tertiary-octyl acrylamide (4223-03-4)

Guidance literature:

With sulfuric acid; acetic acid; anschliessend mit Eis;

DOI:10.1021/ja01153a005

upstream raw materials:

2,4,4-trimethyl-1-pentene

acrylonitrile

β-diethylamino-N-tert-octylpropionamide

Refernces