1-Chloro-3-heptoxypropan-2-ol

Base Information

• Chemical Name: 1-Chloro-3-heptoxypropan-2-ol
• CAS No.: 42032-43-9
• Molecular Formula: C₁₀H₂₁ClO₂
• Molecular Weight: 208.729
• NSC Number: 86979
• DSSTox Substance ID: DTXSID10293047
• Mol file: 42032-43-9.mol

Synonyms:42032-43-9;1-chloro-3-heptoxypropan-2-ol;NSC86979;NCIOpen2_005289;DTXSID10293047;NSC-86979

Chemical Property of 1-Chloro-3-heptoxypropan-2-ol

Chemical Property:

• Vapor Pressure: 0.000206mmHg at 25°C
• Boiling Point: 291.7°Cat760mmHg
• Flash Point: 130.2°C
• Density: 0.997g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 208.1230076
• Heavy Atom Count: 13
• Complexity: 98.9

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCOCC(CCl)O

Technology Process of 1-Chloro-3-heptoxypropan-2-ol

There total 1 articles about 1-Chloro-3-heptoxypropan-2-ol 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:

n-heptan1ol (111-70-6) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 1-chloro-3-heptyloxy-propan-2-ol (42032-43-9)

Guidance literature:

With sulfuric acid;

DOI:10.1021/jo01135a001

Reference yield:

1-chloro-3-heptyloxy-propan-2-ol (42032-43-9) + 2-(2-methoxy-phenoxy)-ethylamine (1836-62-0) → 1-Heptyloxy-3-[2-(2-methoxy-phenoxy)-ethylamino]-propan-2-ol (10461-32-2)

Guidance literature:

DOI:10.1021/jm00324a004

upstream raw materials:

n-heptan1ol

epichlorohydrin

Downstream raw materials:

1-Heptyloxy-3-[2-(2-methoxy-phenoxy)-ethylamino]-propan-2-ol

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