Nonyl isocyanate

Base Information

• Chemical Name: Nonyl isocyanate
• CAS No.: 4184-73-0
• Molecular Formula: C10H19NO
• Molecular Weight: 169.267
• Hs Code.: 2929109000
• European Community (EC) Number: 623-591-2
• DSSTox Substance ID: DTXSID20460809
• Nikkaji Number: J1.983.778E
• Mol file: 4184-73-0.mol

Synonyms:Nonyl isocyanate;1-isocyanatononane;4184-73-0;n-nonyl isocyanate;Nonyl isocyanate 97;Nonyl isocyanate, 97%;SCHEMBL14935;DTXSID20460809;DLGUAUVHTOCKTB-UHFFFAOYSA-N;AKOS010078728

Chemical Property of Nonyl isocyanate

Chemical Property:

• Vapor Pressure: 0.494mmHg at 25°C
• Refractive Index: n20/D 1.4350(lit.)
• Boiling Point: 222-223oC(lit.)
• Flash Point: 199 °F
• PSA: 29.43000
• Density: 0.870 g/mL at 25oC(lit.)
• LogP: 3.07280
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 169.146664230
• Heavy Atom Count: 12
• Complexity: 128

Purity/Quality:

98%Min ^*data from raw suppliers

NONYL ISOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38-42
• Safety Statements: 23-26-36

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCN=C=O

Technology Process of Nonyl isocyanate

There total 8 articles about Nonyl isocyanate 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: 65.0%

decanoyl azide (157071-26-6) → nonyl isocyanate (4184-73-0)

Guidance literature:

In toluene; at 60 ℃; for 2h;

DOI:10.1016/S0040-4020(01)85430-2

Reference yield: 47.0%

→ nonyl isocyanate (4184-73-0)

Guidance literature:

Reference yield:

n-decanoyl chloride (112-13-0) → nonyl isocyanate (4184-73-0)

Guidance literature:

With sodium azide; Yield given. Multistep reaction; 1) water, acetone, 10-15 deg C, 2 h; 2) benzene, 30 min, 60-68 deg C, then 2h, 70 deg C;

DOI:10.1135/cccc19800517

upstream raw materials:

1-decanoic acid

decanoyl azide

n-decanoyl chloride

n-Nonylamin

Downstream raw materials:

n-Nonylamin

4-chloro-2-(3-chlorophenylcarbamoyl)phenyl nonylcarbamate

4-chloro-2-(3,4-dichlorophenylcarbamoyl)phenyl nonylcarbamate

4-chloro-2-(4-chlorophenylcarbamoyl)phenyl nonylcarbamate