1-Cyclohexyl-1-propyl acetate

Base Information

• Chemical Name: 1-Cyclohexyl-1-propyl acetate
• CAS No.: 2114-32-1
• Molecular Formula: C11H20 O2
• Molecular Weight: 184.279
• European Community (EC) Number: 218-313-8
• DSSTox Substance ID: DTXSID40883798
• Nikkaji Number: J298.705H
• Mol file: 2114-32-1.mol

Synonyms:1-Cyclohexyl-1-propyl acetate;2114-32-1;1-cyclohexylpropyl acetate;SCHEMBL2380868;(+)-1-cyclohexylpropyl acetate;(+)-1 -cyclohexylpropyl acetate;DTXSID40883798;Acetic acid 1-cyclohexylpropyl ester;EINECS 218-313-8;Cyclohexanemethanol, alpha-ethyl-, acetate;Cyclohexanemethanol, .alpha.-ethyl-, acetate;Cyclohexanemethanol, alpha-ethyl-, 1-acetate;Cyclohexanemethanol, .alpha.-ethyl-, 1-acetate

Chemical Property of 1-Cyclohexyl-1-propyl acetate

Chemical Property:

• Vapor Pressure: 0.112mmHg at 25°C
• Boiling Point: 220.6°Cat760mmHg
• Flash Point: 83.7°C
• PSA: 26.30000
• Density: 0.944g/cm³
• LogP: 2.90840
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 184.146329876
• Heavy Atom Count: 13
• Complexity: 160

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1CCCCC1)OC(=O)C

Technology Process of 1-Cyclohexyl-1-propyl acetate

There total 7 articles about 1-Cyclohexyl-1-propyl acetate 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: 97.0%

cyclohexanecarbaldehyde (2043-61-0) → (+)-1-cyclohexyl-2-propyl acetate (2114-32-1)

Guidance literature:

With ammonium chloride; acetic anhydride; In hexane; ethyl acetate; toluene;

Reference yield: 81.0%

ammonium chloride + cyclohexanecarbaldehyde (2043-61-0) → (+)-1-cyclohexyl-2-propyl acetate (2114-32-1)

Guidance literature:

With acetic anhydride; In hexane; ethyl acetate; toluene;

Reference yield:

1-<1-Acetoxy-allyl>-cyclohexen-(1) (7014-63-3) → (+)-1-cyclohexyl-2-propyl acetate (2114-32-1)

Guidance literature:

With hydrogen; platinum on activated charcoal;

upstream raw materials:

1-<1-Acetoxy-allyl>-cyclohexen-(1)

1-<1-Acetoxy-propin-(2)-yl>-cyclohexen-(1)

cyclohexanecarbaldehyde

diethylzinc

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