Urea, 1-(3-chloropropyl)-3-cyclohexyl-

Base Information

• Chemical Name: Urea, 1-(3-chloropropyl)-3-cyclohexyl-
• CAS No.: 14848-54-5
• Molecular Formula: C₁₀H₁₉ClN₂O
• Molecular Weight: 218.727
• NSC Number: 81174
• DSSTox Substance ID: DTXSID00933420
• Wikidata: Q82909234
• Mol file: 14848-54-5.mol

Synonyms:14848-54-5;NSC81174;DTXSID00933420;HDOYDJRZQZWQTC-UHFFFAOYSA-N;NSC-81174;N-(3-Chloropropyl)-N'-cyclohexylurea #;Urea, 1-(3-chloropropyl)-3-cyclohexyl-;N'-(3-Chloropropyl)-N-cyclohexylcarbamimidic acid

Chemical Property of Urea, 1-(3-chloropropyl)-3-cyclohexyl-

Chemical Property:

• Vapor Pressure: 1.34E-06mmHg at 25°C
• Boiling Point: 399.7°Cat760mmHg
• Flash Point: 195.5°C
• Density: 1.09g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 218.1185909
• Heavy Atom Count: 14
• Complexity: 170

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)NC(=O)NCCCCl

Technology Process of Urea, 1-(3-chloropropyl)-3-cyclohexyl-

There total 1 articles about Urea, 1-(3-chloropropyl)-3-cyclohexyl- 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: 64.0%

3-Chloropropyl isocyanate (13010-19-0) + cyclohexylamine (108-91-8,157973-60-9) → 1-(3-chloropropyl)-3-cyclohexylurea (14848-54-5)

Guidance literature:

In dichloromethane; at 0 - 20 ℃;

DOI:10.1021/jm301617j

Reference yield: 8.0%

1-(3-chloropropyl)-3-cyclohexylurea (14848-54-5) + vanillin (121-33-5,8014-42-4) → 1-cyclohexyl-3-[3-(4-formyl-2-methoxyphenoxy)propyl]urea (1422166-50-4)

Guidance literature:

vanillin; With caesium carbonate; In N,N-dimethyl-formamide; at 70 ℃; for 0.5h;

1-(3-chloropropyl)-3-cyclohexylurea; In N,N-dimethyl-formamide; at 70 ℃;

DOI:10.1021/jm301617j

Reference yield:

1-(3-chloropropyl)-3-cyclohexylurea (14848-54-5) → C10H18ClN3O2 (13907-68-1)

Guidance literature:

With formic acid; sodium nitrite;

DOI:10.1021/jm00324a026

upstream raw materials:

3-Chloropropyl isocyanate

cyclohexylamine

Downstream raw materials:

C₁₀H₁₈ClN₃O₂

C₃₁H₄₃N₅O₃

1-cyclohexyl-3-[3-(4-formyl-2-methoxyphenoxy)propyl]urea