1-Isocyanato-2-methoxyethane

Base Information

• Chemical Name: 1-Isocyanato-2-methoxyethane
• CAS No.: 42170-95-6
• Molecular Formula: C4H7NO2
• Molecular Weight: 101.105
• Hs Code.: 2929109000
• European Community (EC) Number: 822-470-3
• DSSTox Substance ID: DTXSID60559928
• Mol file: 42170-95-6.mol

Synonyms:1-isocyanato-2-methoxyethane;42170-95-6;MFCD09673759;1-Isocyanato-2-methoxy-ethane;2-methoxyethylisocyanate;2-Methoxy-ethyl isocyanate;SCHEMBL165066;DTXSID60559928;IVMHNKJWTRJTRU-UHFFFAOYSA-N;AKOS004093384;AB50988;1-Isocyanato-2-methoxyethane, AldrichCPR;BS-12756;3,5-DiMethylpyrazole-1-carboxamidinenitrate;EN300-75661;D87777;A913592;F2163-0006;Z1094719556

Chemical Property of 1-Isocyanato-2-methoxyethane

Chemical Property:

• Vapor Pressure: 19.037mmHg at 25°C
• Boiling Point: 115.447oC at 760 mmHg
• Flash Point: 29.454oC
• PSA: 38.66000
• Density: 0.972g/cm3
• LogP: -0.03140
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 101.047678466
• Heavy Atom Count: 7
• Complexity: 75.8

Purity/Quality:

97% ^*data from raw suppliers

1-Isocyanato-2-methoxyethane ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCCN=C=O

Technology Process of 1-Isocyanato-2-methoxyethane

There total 5 articles about 1-Isocyanato-2-methoxyethane 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:

water (7732-18-5) + O-benzoyl-N-(3-methoxy-propionyl)-hydroxylamine; potassium salt → 2-isocyanatoethyl methyl ether (42170-95-6) + benzoic acid (65-85-0,8013-63-6)

Guidance literature:

Reference yield:

silver cyanate (3315-16-0) + 2-iodo-1-methoxyethane (4296-15-5) → 2-isocyanatoethyl methyl ether (42170-95-6)

Guidance literature:

With diethyl ether; at 150 ℃;

Reference yield:

→ 2-isocyanatoethyl methyl ether (42170-95-6)

Guidance literature:

With water;

upstream raw materials:

silver cyanate

2-iodo-1-methoxyethane

water

phosgene

Downstream raw materials:

1-(2-Methoxy-ethyl)-3-[4-(4-nitro-phenylsulfanyl)-phenyl]-urea