Butyramide

Base Information

• Chemical Name: Butyramide
• CAS No.: 541-35-5
• Deprecated CAS: 42861-32-5
• Molecular Formula: C4H9NO
• Molecular Weight: 87.1216
• Hs Code.: 29241900
• European Community (EC) Number: 208-776-4
• NSC Number: 8424
• UNII: 9J6OR937VR
• DSSTox Substance ID: DTXSID8060248
• Nikkaji Number: J2.639E
• Wikipedia: Butyramide
• Wikidata: Q5003189
• Metabolomics Workbench ID: 46252
• ChEMBL ID: CHEMBL1231396
• Mol file: 541-35-5.mol

Synonyms:butyramide

Chemical Property of Butyramide

Chemical Property:

• Appearance/Colour: Colorless to white crystalline powder or flakes
• Vapor Pressure: 0.143mmHg at 25°C
• Melting Point: 114-116 °C
• Refractive Index: 1.42
• Boiling Point: 216 °C at 760 mmHg
• PKA: 16.67±0.40(Predicted)
• Flash Point: 87.9 °C
• PSA: 43.09000
• Density: 0.913 g/cm³
• LogP: 0.97210
• Storage Temp.: Store below +30°C.
• Solubility.: alcohol: soluble(lit.)
• Water Solubility.: soluble
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 87.068413911
• Heavy Atom Count: 6
• Complexity: 51.5

Purity/Quality:

99.9% ^*data from raw suppliers

Butyramide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Solvents -> Amides (
• Canonical SMILES: CCCC(=O)N
• Uses: Butyramide was used in the synthesis of hydroxamic acids, electrorheological fluids and β-amodoorganotin compounds. It was used as substrate of (+)-γ-lactamase to develop a microreactor to study enzyme stability, activity, kinetics and substrate specificity.

Technology Process of Butyramide

There total 92 articles about Butyramide 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%

butyraldehyde oxime (110-69-0) → butanamide (541-35-5)

Guidance literature:

With nickel(II) chloride hexahydrate; ¹⁸O-labeled water; at 155 ℃; for 18h; Inert atmosphere;

DOI:10.1021/ol101978h

Reference yield: 100.0%

propyl cyanide (109-74-0) → butanamide (541-35-5)

Guidance literature:

With manganese(IV) oxide; silica gel; In hexane; for 16h; Heating;

DOI:10.1055/s-1988-27684

Reference yield: 100.0%

butyric acid (107-92-6) → butanamide (541-35-5)

Guidance literature:

With Candida antarctica lipase B; ammonium carbamate; In various solvent(s); at 25 ℃; for 408h;

DOI:10.1039/a904060i

upstream raw materials:

tetrachloromethane

N-(2,2,2-tribromo-1-hydroxy-ethyl)-butyramide

propyl cyanide

1,1-dimethoxybutane

Downstream raw materials:

N-xanthen-9-yl-butyramide

butyryl-(2-methyl-butyryl)-amine

2-Pentanone

propylamine

Refernces

• 1、 Yablokov,Smel'tsova,Zelyaev,Mitrofanova. "Studies of the rates of thermal decomposition of glycine, alanine, and serine". . p. 1704 - 1706. Retrieved 2009.
• 2、 Ben-David, Yehoshoa,Diskin-Posner, Yael,Kar, Sayan,Milstein, David,Zhou, Quan-Quan,Zou, You-Quan. "Manganese-Pincer-Catalyzed Nitrile Hydration, α-Deuteration, and α-Deuterated Amide Formation via Metal Ligand Cooperation". . p. 10239 - 10245. Retrieved 2021/08/24.
• 3、 Vyas, Komal M.,Mandal, Poulami,Singh, Rinky,Mobin, Shaikh M.,Mukhopadhyay, Suman. "Arene-ruthenium(II)-phosphine complexes: Green catalysts for hydration of nitriles under mild conditions". . . Retrieved 2019/12/11.