N,N-Bis(2-methylpropyl)formamide

Base Information

• Chemical Name: N,N-Bis(2-methylpropyl)formamide
• CAS No.: 2591-76-6
• Molecular Formula: C9H19NO
• Molecular Weight: 157.256
• Hs Code.: 2924199090
• European Community (EC) Number: 219-983-4
• DSSTox Substance ID: DTXSID30180581
• Nikkaji Number: J192.102I
• Wikidata: Q83051143
• Mol file: 2591-76-6.mol

Synonyms:n,n-diisobutylformamide;2591-76-6;N,N-Bis(2-methylpropyl)formamide;EINECS 219-983-4;Formamide, N,N-bis(2-methylpropyl)-;Diisobutylformamid;N,N-Diisobutyl-formamide;SCHEMBL269711;DTXSID30180581;CAA59176;N,N-bis-(2-Methylpropyl)formamide;MFCD00042942;AKOS006227667;BS-16751;CS-0187561;FT-0688503;A19570;D82484

Chemical Property of N,N-Bis(2-methylpropyl)formamide

Chemical Property:

• Vapor Pressure: 0.0287mmHg at 25°C
• Refractive Index: n20/D 1.442
• Boiling Point: 245.5 °C at 760 mmHg
• Flash Point: 91.9 °C
• PSA: 20.31000
• Density: 0.862 g/cm³
• LogP: 2.39270
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Water Solubility.: 13g/L at 20℃
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 157.146664230
• Heavy Atom Count: 11
• Complexity: 100

Purity/Quality:

97% ^*data from raw suppliers

N,N-Diisobutylformamide 95+% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N,N-Bis(2-methylpropyl)formamide

There total 12 articles about N,N-Bis(2-methylpropyl)formamide 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%

diisobutylamine (110-96-3) + formamide (77287-34-4,77287-35-5,60100-09-6) → N,N-bis(2-methylpropyl)formamide (2591-76-6)

Guidance literature:

With Iron(III) nitrate nonahydrate; In toluene; for 12h; Reflux;

DOI:10.1021/jo500562w

Reference yield: 83.0%

diisobutylamine (110-96-3) + dihydroxyacetone (96-26-4,26776-70-5) → N,N-bis(2-methylpropyl)formamide (2591-76-6)

Guidance literature:

With Cu/Al₂O₃; dihydrogen peroxide; In water; at 25 ℃; for 24h; Green chemistry;

Reference yield: 51.0%

N,N-diisobutyl-2-methyl-1-propen-1-ylamine (19244-89-4) → N,N-bis(2-methylpropyl)formamide (2591-76-6)

Guidance literature:

With tris(2 2'-bipyridyl)ruthenium(II) chloride hexahydrate; oxygen; caesium carbonate; In acetonitrile; at 20 ℃; for 16h; Irradiation; Inert atmosphere;

DOI:10.1055/s-0034-1378205

upstream raw materials:

formic acid

diisobutylamine

chloroform

carbon monoxide

Downstream raw materials:

diisobutyl-pent-1-enyl-amine