4-(1-Cyclohexenyl)-butyraldehyde

Base Information

• Chemical Name: 4-(1-Cyclohexenyl)-butyraldehyde
• CAS No.: 50639-01-5
• Molecular Formula: C₁₀H₁₆O
• Molecular Weight: 152.236
• DSSTox Substance ID: DTXSID001313747
• Mol file: 50639-01-5.mol

Synonyms:4-(1-cyclohexenyl)-butyraldehyde;1-Cyclohexene-1-butanal;SCHEMBL826064;4-(1-cyclohexen-1-yl)butanal;DTXSID001313747;50639-01-5

Chemical Property of 4-(1-Cyclohexenyl)-butyraldehyde

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 152.120115130
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC(=CC1)CCCC=O

Technology Process of 4-(1-Cyclohexenyl)-butyraldehyde

There total 6 articles about 4-(1-Cyclohexenyl)-butyraldehyde 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: 75.0%

4-(Cyclohexen-1-yl)-propyltosylat (29875-10-3) → 4-(cyclohex-1-en-1-yl)butanal (50639-01-5)

Guidance literature:

In tetrahydrofuran; for 3h; Heating;

DOI:10.1016/0040-4039(80)88094-4

Reference yield: 35.7%

1-oxa-spiro[5.5]undecan-2-one (4481-78-1) → 4-(cyclohex-1-en-1-yl)butanal (50639-01-5)

Guidance literature:

With formic acid; manganese(II) sulfate; pumice; at 450 ℃;

DOI:10.1002/hlca.200490153

Reference yield: 17.0%

(3Z)-3-(hydroxymethylene)-1-oxaspiro[5.5]undecan-2-one (1322113-83-6) → 1-oxa-spiro[5.5]undecan-2-one (4481-78-1) + 4-(cyclohex-1-en-1-yl)butanal (50639-01-5)

Guidance literature:

With acetic acid; In tetrahydrofuran; at 460 ℃; for 13h; Inert atmosphere;

DOI:10.1002/hlca.201000447

upstream raw materials:

4-Cyclohex-1-enyl-butyric acid methyl ester

4-(Cyclohexen-1-yl)-propyltosylat

1-oxa-spiro[5.5]undecan-2-one

methylenecyclohexane