4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate

Base Information

Chemical Name:4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate
CAS No.:116064-83-6
Molecular Formula:C₁₇H₁₉NO₂
Molecular Weight:269.343
Hs Code.:
DSSTox Substance ID:DTXSID701230380
Mol file:116064-83-6.mol

Synonyms:4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate;DTXSID701230380;116064-83-6

Suppliers and Price of 4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of 4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:269.141578849
Heavy Atom Count:20
Complexity:410

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCC1=CCC(CC1)C(=O)OC2=CC=C(C=C2)C#N

Technology Process of 4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate

There total 3 articles about 4-Cyanophenyl 4-propyl-3-cyclohexene-1-carboxylate 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:

: 17159-79-4
ethyl 4-oxocyclohexane-1-carboxylate

: 116064-83-6
4-Propyl-cyclohex-3-enecarboxylic acid 4-cyano-phenyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 1) (C₂H₅)2O, 2 h, 2) overnight

2: 2) alkali / 1) 350 deg C, distillation, 2) alcohol, reflux, 5.5 h

3: 1) SOCl₂, 2) pyridine / 2) (C₂H₅)2O, 6 h

With pyridine; thionyl chloride;

Reference yield:

: 4-Acetoxy-4-propyl-cyclohexanecarboxylic acid ethyl ester

: 116064-83-6
4-Propyl-cyclohex-3-enecarboxylic acid 4-cyano-phenyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 2) alkali / 1) 350 deg C, distillation, 2) alcohol, reflux, 5.5 h

2: 1) SOCl₂, 2) pyridine / 2) (C₂H₅)2O, 6 h

With pyridine; thionyl chloride;