4-(4-Pentylcyclohexyl)benzamide

Base Information

• Chemical Name: 4-(4-Pentylcyclohexyl)benzamide
• CAS No.: 73011-80-0
• Molecular Formula: C18H27NO
• Molecular Weight: 273.418
• DSSTox Substance ID: DTXSID401268526
• ChEMBL ID: CHEMBL1888312
• Mol file: 73011-80-0.mol

Synonyms:4-(4-pentylcyclohexyl)benzamide;4-(4-Pentyl-cyclohexyl)-benzamide;66227-35-8;MLS000560950;CHEMBL1888312;SCHEMBL11340158;SCHEMBL11340160;DTXSID401268526;HMS2161H03;HMS3314F03;AKOS000511683;SMR000174010;FT-0756073;AH-034/32470025;SR-01000388897;BENZAMIDE, 4-(4-PENTYLCYCLOHEXYL)-, TRANS-;SR-01000388897-1;73011-80-0

Chemical Property of 4-(4-Pentylcyclohexyl)benzamide

Chemical Property:

• XLogP3: 5.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 273.209264485
• Heavy Atom Count: 20
• Complexity: 286

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)N

Technology Process of 4-(4-Pentylcyclohexyl)benzamide

There total 14 articles about 4-(4-Pentylcyclohexyl)benzamide 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:

4-n-pentylcyclohexanone (61203-83-6) → 4-(4-Pentyl-cyclohexyl)-benzamide (73011-80-0)

Guidance literature:

Multi-step reaction with 7 steps

1: 2.) 10percent aq. HCl / 1.) diethyl ether, 1 h, heating

2: p-toluenesulfonic acid / toluene / Heating

3: H₂ / 10percent Pd/C / ethanol

4: AlCl₃ / 1,2-dichloro-ethane / 0.5 h

5: aq. NaOH, Br₂ / dioxane / 3 h / 35 - 40 °C

6: SOCl₂ / 1 h / Heating

7: 25percent aq. NH₄OH

With hydrogenchloride; ammonium hydroxide; sodium hydroxide; aluminium trichloride; thionyl chloride; hydrogen; bromine; toluene-4-sulfonic acid; palladium on activated charcoal; In 1,4-dioxane; ethanol; 1,2-dichloro-ethane; toluene;

Reference yield:

phenylmagnesium bromide → 4-(4-Pentyl-cyclohexyl)-benzamide (73011-80-0)

Guidance literature:

Multi-step reaction with 7 steps

1: 2.) 10percent aq. HCl / 1.) diethyl ether, 1 h, heating

2: p-toluenesulfonic acid / toluene / Heating

3: H₂ / 10percent Pd/C / ethanol

4: AlCl₃ / 1,2-dichloro-ethane / 0.5 h

5: aq. NaOH, Br₂ / dioxane / 3 h / 35 - 40 °C

6: SOCl₂ / 1 h / Heating

7: 25percent aq. NH₄OH

With hydrogenchloride; ammonium hydroxide; sodium hydroxide; aluminium trichloride; thionyl chloride; hydrogen; bromine; toluene-4-sulfonic acid; palladium on activated charcoal; In 1,4-dioxane; ethanol; 1,2-dichloro-ethane; toluene;

Reference yield:

(4-n-pentylcyclohexen-1-yl)-benzene (88069-97-0) → 4-(4-Pentyl-cyclohexyl)-benzamide (73011-80-0)

Guidance literature:

Multi-step reaction with 5 steps

1: H₂ / 10percent Pd/C / ethanol

2: AlCl₃ / 1,2-dichloro-ethane / 0.5 h

3: aq. NaOH, Br₂ / dioxane / 3 h / 35 - 40 °C

4: SOCl₂ / 1 h / Heating

5: 25percent aq. NH₄OH

With ammonium hydroxide; sodium hydroxide; aluminium trichloride; thionyl chloride; hydrogen; bromine; palladium on activated charcoal; In 1,4-dioxane; ethanol; 1,2-dichloro-ethane;

upstream raw materials:

4-(trans-4'-n-Pentylcyclohexyl)benzoic acid chloride

4-(Trans-4'-pentylcyclohexyl)-benzoic acid

4-n-pentylcyclohexanone

4-(4'-pentyl-cyclohexyl)-acetophenone

Downstream raw materials:

4-(trans-4-pentylcyclohexyl)benzonitrile