2,2-Dimethylhex-3-ene

Base Information

• Chemical Name: 2,2-Dimethylhex-3-ene
• CAS No.: 3123-93-1
• Molecular Formula: C8H16
• Molecular Weight: 112.215
• European Community (EC) Number: 221-504-9
• Mol file: 3123-93-1.mol

Synonyms:2,2-Dimethylhex-3-ene;3-Hexene, 2,2-dimethyl-, (3Z)-;FT-0634683;FT-0694202

Chemical Property of 2,2-Dimethylhex-3-ene

Chemical Property:

• Vapor Pressure: 34.3mmHg at 25°C
• Boiling Point: 105.5°Cat760mmHg
• Flash Point: 8.4°C
• PSA: 0.00000
• Density: 0.727g/cm³
• LogP: 2.99870
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 112.125200510
• Heavy Atom Count: 8
• Complexity: 72.5

Purity/Quality:

99% ^*data from raw suppliers

TRANS-2,2-DIMETHYL-3-HEXENE 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC=CC(C)(C)C

Technology Process of 2,2-Dimethylhex-3-ene

There total 1 articles about 2,2-Dimethylhex-3-ene 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:

tert-butylethylene (558-37-2) + ethanol (64-17-5) → 2-t-butylbutene (18231-53-3) + 2,2-Dimethyl-trans-3-hexene (3123-93-1)

Guidance literature:

With [(C₆H₆)(PCy₃)(CO)RuH]⁺*BF₄^?; In chlorobenzene; at 110 ℃; Autoclave;

DOI:10.1126/science.1208839

Reference yield: 75.0%

Benzylidenemalononitrile (2700-22-3) + 2,2-Dimethyl-trans-3-hexene (3123-93-1) → C18H22N2

Guidance literature:

With 9-(2-mesityl)-10-methylacridinium perchlorate; In 1,2-dichloro-ethane; at 20 ℃; regioselective reaction; Irradiation; Flow reactor; Green chemistry;

DOI:10.1039/c7sc00953d

upstream raw materials:

tert-butylethylene

ethanol

Refernces