N,N-Dibutylacetamide

Base Information

• Chemical Name: N,N-Dibutylacetamide
• CAS No.: 1563-90-2
• Molecular Formula: C10H21 N O
• Molecular Weight: 171.283
• Hs Code.: 2924199090
• European Community (EC) Number: 216-358-8
• NSC Number: 54116,90
• UNII: C69P29RX5K
• DSSTox Substance ID: DTXSID1061786
• Nikkaji Number: J102.363B
• Wikidata: Q27275249
• Mol file: 1563-90-2.mol

Synonyms:N,N-Dibutylacetamide;1563-90-2;N,N-di-n-Butylacetamide;Acetamide, N,N-dibutyl-;UNII-C69P29RX5K;C69P29RX5K;NSC 90;NSC-90;EINECS 216-358-8;NSC 54116;NSC-54116;Acetamide,N-dibutyl-;AI3-02184;NN-Dibutylacetamide;n,n-dibutyl-acetamide;N-ACETYLDIBUTYLAMINE;NSC90;SCHEMBL497913;DTXSID1061786;MEXKFCWMWJZDMF-UHFFFAOYSA-;BAA56390;NSC54116;MFCD00027190;AKOS003869914;AS-57890;CS-0152120;FT-0629572;C72955;Q27275249

Chemical Property of N,N-Dibutylacetamide

Chemical Property:

• Vapor Pressure: 0.0555mmHg at 25°C
• Melting Point: 241-244℃
• Refractive Index: 1.4470
• Boiling Point: 233.6 °C at 760 mmHg ,77-78°C 0,6mm
• PKA: -0.41±0.70(Predicted)
• Flash Point: 87.7 °C
• PSA: 20.31000
• Density: 0.865 g/cm³
• LogP: 2.43510
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 171.162314293
• Heavy Atom Count: 12
• Complexity: 115

Purity/Quality:

97% ^*data from raw suppliers

N,N-DIBUTYLACETAMIDE Aldrich ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Other Nitrogen Compounds
• Canonical SMILES: CCCCN(CCCC)C(=O)C

Technology Process of N,N-Dibutylacetamide

There total 34 articles about N,N-Dibutylacetamide 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: 99.0%

vinyl acetate (108-05-4,9003-20-7) + dibutylamine (111-92-2) → N,N-dibutylacetamide (1563-90-2)

Guidance literature:

With immobilization of Candida cylindracea lipase; In hexane; at 55 ℃; for 12h; Solvent; Temperature; Concentration;

DOI:10.1016/j.procbio.2013.06.009

Reference yield: 99.0%

N,N-di-n-butylbenzylamine (4383-27-1) + acetic anhydride (108-24-7) → N,N-dibutylacetamide (1563-90-2)

Guidance literature:

With nickel dichloride; at 160 ℃; for 16h;

DOI:10.1016/0022-328X(83)80066-7

Reference yield: 92.0%

tributyl-amine (102-82-9) + acetic anhydride (108-24-7) → N,N-dibutylacetamide (1563-90-2)

Guidance literature:

With oxygen; copper diacetate; at 85 ℃; for 36h; Schlenk technique; Sealed tube;

DOI:10.1039/c5cc07454a

upstream raw materials:

ethanol

tetra-N-butyl-vinylidenediamine

N-butylacetamide

N-chloro-N,N-dibutylamine

Downstream raw materials:

2-propylbenzo[d]thiazole

Atrasentan hydrochloride

3-acetylindole