2,4-Hexadiene, 2,5-dimethyl-3,4-bis(1-methylethyl)-

Base Information

• Chemical Name: 2,4-Hexadiene, 2,5-dimethyl-3,4-bis(1-methylethyl)-
• CAS No.: 54580-23-3
• Molecular Formula: C₁₄H₂₆
• Molecular Weight: 194.36
• Hs Code.: 2901299090
• DSSTox Substance ID: DTXSID60203010
• Mol file: 54580-23-3.mol

Synonyms:2,4-Hexadiene, 2,5-dimethyl-3,4-bis(1-methylethyl)-;54580-23-3;DTXSID60203010;3,4-diisopropyl-2,5-dimethyl-hexa-2,4-diene

Chemical Property of 2,4-Hexadiene, 2,5-dimethyl-3,4-bis(1-methylethyl)-

Chemical Property:

• Vapor Pressure: 0.0306mmHg at 25°C
• Boiling Point: 252.6°C at 760 mmHg
• Flash Point: 98.8°C
• PSA: 0.00000
• Density: 0.787g/cm³
• LogP: 4.97120
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 194.203450829
• Heavy Atom Count: 14
• Complexity: 213

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(=C(C)C)C(=C(C)C)C(C)C

Technology Process of 2,4-Hexadiene, 2,5-dimethyl-3,4-bis(1-methylethyl)-

There total 12 articles about 2,4-Hexadiene, 2,5-dimethyl-3,4-bis(1-methylethyl)- 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:

2,4-dimethyl-2,3-pentadiene (1000-87-9) → 3,4-Diisopropyl-2,5-dimethyl-2,4-hexadien (54580-23-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 80 h / 225 °C

2: hydrogen / 10percent palladium on charcoal / methanol

With hydrogen; palladium on activated charcoal; In methanol;

Reference yield:

4-isopropyl-3-isopropylidene-2,5-dimethylhexa-1,4-diene (54580-22-2) → 3,4-Diisopropyl-2,5-dimethyl-2,4-hexadien (54580-23-3)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol;

Reference yield:

3,3,3',3',5,5,5',5'-octamethyl-3,3',5,5'-tetrahydro-4,4'-bi(4H-pyrazolylidene) (69856-67-3) → 3,4-Diisopropyl-2,5-dimethyl-2,4-hexadien (54580-23-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 64 percent Chromat_. / 0 h / 570 °C / 0 - 0.01 Torr

2: hydrogen / 10percent palladium on charcoal / methanol

With hydrogen; palladium on activated charcoal; In methanol;

upstream raw materials:

2,5-dimethyl-2,5-diacetoxy-3-hexyne

isopropylmagnesium bromide

4-isopropyl-3-isopropylidene-2,5-dimethylhexa-1,4-diene

3,3,3',3',5,5,5',5'-octamethyl-3,3',5,5'-tetrahydro-4,4'-bi(4H-pyrazolylidene)