2-Ethylidenehexanal

Base Information

• Chemical Name: 2-Ethylidenehexanal
• CAS No.: 87745-65-1
• Molecular Formula: C8H14O
• European Community (EC) Number: 246-950-1
• UNII: C09PCM2QXX
• DSSTox Substance ID: DTXSID901339051
• Metabolomics Workbench ID: 47641
• Mol file: 87745-65-1.mol

Synonyms:2-Ethylidenehexanal;(2E)-2-ethylidenehexanal;2-Butyl-2-butenal;FEMA No. 3392;2-Butyl-2-butenal, (2E)-;Hexanal, 2-ethylidene-, (E)-;UNII-C09PCM2QXX;C09PCM2QXX;Hexanal, 2-ethylidene-, (2E)-;2-Butyl-2-butenal [FHFI];87745-65-1;EINECS 246-950-1;2-Ethylidinehexanal;25409-08-9;(2E)-2-butyl-2-butenal;2-ETHYLIDENE-HEXANAL;SCHEMBL3072582;FEMA 3392;CHEBI:172020;DTXSID901339051;Q27275008

Chemical Property of 2-Ethylidenehexanal

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 126.104465066
• Heavy Atom Count: 9
• Complexity: 103

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(=CC)C=O
• Isomeric SMILES: CCCC/C(=C\C)/C=O

Technology Process of 2-Ethylidenehexanal

There total 1 articles about 2-Ethylidenehexanal 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:

1-(3-Butyl-2-trimethylsilanyl-oxiranyl)-ethanol (88829-93-0) → (E)-2-methyl-hept-2-enal (30567-26-1) + (E)-2-ethylidenehexanal (87745-65-1)

Guidance literature:

With boron trifluoride diethyl etherate; In dichloromethane; for 0.25h; Yield given. Yields of byproduct given; Ambient temperature;

DOI:10.1039/c39830001024

upstream raw materials:

1-(3-Butyl-2-trimethylsilanyl-oxiranyl)-ethanol