2-Morpholinoethyl isocyanide

Base Information

• Chemical Name: 2-Morpholinoethyl isocyanide
• CAS No.: 78375-48-1
• Molecular Formula: C7H12N2O
• Molecular Weight: 140.185
• Hs Code.: 2934999090
• European Community (EC) Number: 684-902-5
• DSSTox Substance ID: DTXSID50374788
• Nikkaji Number: J370.741E
• Wikidata: Q72492961
• Mol file: 78375-48-1.mol

Synonyms:2-Morpholinoethylisocyanide;4-(2-Isocyanoethyl)morpholine;Morpholinoethyl isocyanide;N-(2-Isocyanoethyl)morpholine;

Chemical Property of 2-Morpholinoethyl isocyanide

Chemical Property:

• Refractive Index: n20/D 1.469
• Boiling Point: 72-73 °C at 0.7 mm Hg(lit.)
• Flash Point: 110 °C
• PSA: 12.47000
• Density: 1.017 g/mL at 20 °C(lit.)
• LogP: -0.59350
• Storage Temp.: −20°C
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 140.094963011
• Heavy Atom Count: 10
• Complexity: 132

Purity/Quality:

99% ^*data from raw suppliers

2-Morpholinoethyl isocyanide ≥98.0% (GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 23/24/25-36/37/38
• Safety Statements: 26-36/37-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [C-]#[N+]CCN1CCOCC1
• Uses: 2-Morpholinoethyl isocyanide can be used for the synthesis of:Nitrogen acyclic carbene (NAC) complexes to be used as catalysts for the synthesis of phenol and hydration of alkynes.Variety of imidazo[1,2-a]pyridines and α-acylaminoamides by Ugi condensation reaction.2-Aminobenzoxazoles and 3-aminobenzoxazines having important therapeutic activities.It can also be used as a ligand in bis-cyclometalated iridium complexes for the organic light emitting diodes (OLEDs).

Technology Process of 2-Morpholinoethyl isocyanide

There total 4 articles about 2-Morpholinoethyl isocyanide 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: 74.0%

N-(2-morpholinoethyl)formamide (78375-50-5) → 2-morpholinoethyl isonitrile (78375-48-1)

Guidance literature:

With bis(trichloromethyl) carbonate; triethylamine; at 20 ℃; for 8h;

Reference yield:

4-[2-[bis(2-chloroethyl)amino]phenyl]butyric acid → 4-[2-[bis(2-chloroethyl)amino]phenyl]butyric acid N-hydroxysuccinimido ester + 2-morpholinoethyl isonitrile (78375-48-1)

Guidance literature:

Reference yield:

8-Oxa-2-aza-5-azonia-spiro[4.5]dec-1-ene; chloride (87024-45-1) → 2-morpholinoethyl isonitrile (78375-48-1)

Guidance literature:

With sodium hydroxide;

DOI:10.1007/BF00523090

upstream raw materials:

N-(2-morpholinoethyl)formamide

8-Oxa-2-aza-5-azonia-spiro[4.5]dec-1-ene; chloride

Toluene-4-sulfonate8-oxa-2-aza-5-azonia-spiro[4.5]dec-1-ene;

Refernces

• 1、 -. "Gem-diphosphonic acids, and pharmaceutical compositions containing them". . . Retrieved 2008/06/13.
• 2、 Obrecht, Roland,Herrmann, Rudolf,Ugi, Ivar. "Isocyanide Synthesis with Phosphoryl Chloride and Diisopropylamine". . p. 400 - 402. Retrieved 2007/10/02.