(E)-2-Butylidenecyclohexanone

Base Information

• Chemical Name: (E)-2-Butylidenecyclohexanone
• CAS No.: 7153-14-2
• Molecular Formula: C10H16O
• Molecular Weight: 152.236
• European Community (EC) Number: 230-498-7
• Nikkaji Number: J23.549K,J3.342.527I
• Mol file: 7153-14-2.mol

Synonyms:(E)-2-Butylidenecyclohexanone;2-Butylidenecyclohexanone;2-BUTYLIDENE-1-CYCLOHEXANONE;7153-14-2;2-butylidene cyclohexanone;SCHEMBL9511708;(E)-2-Butylidene-cyclohexanone;(2E)-2-butylidene-cyclohexan-1-one;AKOS006241603

Chemical Property of (E)-2-Butylidenecyclohexanone

Chemical Property:

• Vapor Pressure: 0.033mmHg at 25°C
• Refractive Index: 1.4800 (estimate)
• Boiling Point: 242.9°Cat760mmHg
• Flash Point: 97.6°C
• PSA: 17.07000
• Density: 0.993g/cm³
• LogP: 2.85600
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 152.120115130
• Heavy Atom Count: 11
• Complexity: 168

Purity/Quality:

99% ^*data from raw suppliers

2-BUTYLIDENE-1-CYCLOHEXANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC=C1CCCCC1=O
• Isomeric SMILES: CCC/C=C/1\CCCCC1=O

Technology Process of (E)-2-Butylidenecyclohexanone

There total 19 articles about (E)-2-Butylidenecyclohexanone 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: 78.5%

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) + butyraldehyde (123-72-8) → 2-Buthylidenecyclohexanone (7153-14-2)

Guidance literature:

With sodium hydroxide; at 72 ℃; for 4h;

Reference yield: 67.0%

2-propyl-1,3-dioxolane (3390-13-4) + 1-(Trimethylsilyloxy)cyclohexene (6651-36-1) → 2-Buthylidenecyclohexanone (7153-14-2)

Guidance literature:

With zinc(II) chloride; In ethyl acetate; at 20 ℃; for 3h;

Reference yield: 50.0%

2-n-Butyl-2-methylsulfinylcyclohexanone → 2-butylcyclohex-2-en-1-one (34737-39-8) + 2-Buthylidenecyclohexanone (7153-14-2)

Guidance literature:

With phosphorous acid trimethyl ester; In toluene; for 15h; Heating;

upstream raw materials:

cyclohexanone

butyraldehyde

1-acetoxy-6-bromo-cyclohexene

2-propyl-1,3-dioxolane

Downstream raw materials:

6-hydroxydecanoic acid

2-butylcyclohexanone

3-phenyl-4-propyl-1-oxa-2-aza-spiro[4.5]dec-2-en-6-one

2-[1-(5-Methyl-furan-2-yl)-butyl]-cyclohexanone