6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl-

Base Information

• Chemical Name: 6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl-
• CAS No.: 54325-12-1
• Deprecated CAS: 79906-71-1
• Molecular Formula: C₁₅H₂₄O
• Molecular Weight: 220.355
• European Community (EC) Number: 259-104-1
• DSSTox Substance ID: DTXSID30886096
• Mol file: 54325-12-1.mol

Synonyms:6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl-;EINECS 259-104-1;AI3-25087;54325-12-1;EC 259-104-1;3,7,11-Trimethyl-6,10-dodecadien-1-yn-3-ol;DTXSID30886096;3,7,11-trimethyl-6,10-dodecadien-1-in-3-ol;3,7,11-trimethyldodeca-6,10-dien-l-yne-3-ol;3,7,11-trimethyldodeca-6,10-dien-l-yn- 3-ol

Chemical Property of 6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl-

Chemical Property:

• Vapor Pressure: 2.97E-05mmHg at 25°C
• Refractive Index: 1.49
• Boiling Point: 318.5°C at 760 mmHg
• Flash Point: 289.8°C
• PSA: 20.23000
• Density: 0.902g/cm³
• LogP: 3.84350
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 220.182715385
• Heavy Atom Count: 16
• Complexity: 310

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(=CCCC(C)(C#C)O)C)C

Technology Process of 6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl-

There total 6 articles about 6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl- 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: 90.0%

pseudo-ionone (689-67-8) + acetylene (74-86-2,25067-58-7) → 3,7,11-trimethyl-6,10-dodecadien-1-yn-3-ol (2387-68-0,54325-12-1)

Guidance literature:

DOI:10.1016/S0040-4020(01)91960-X

Reference yield: 88.0%

pseudo-ionone (689-67-8) + acetylenemagnesium bromide (4301-14-8) → 3,7,11-trimethyl-6,10-dodecadien-1-yn-3-ol (2387-68-0,54325-12-1)

Guidance literature:

In tetrahydrofuran; at -78 - 20 ℃; for 1h;

DOI:10.1021/jacs.5b07304

Reference yield:

→ 3,7,11-trimethyl-6,10-dodecadien-1-yn-3-ol (2387-68-0,54325-12-1)

Guidance literature:

With diethyl ether; sodium amide; acetylene;

upstream raw materials:

trans geranyl acetone

acetylene

pseudo-ionone

diethyl ether

Downstream raw materials:

(+/-)-nerolidol

C₂₂H₃₀O

Farnesal

Refernces

• 1、 Carreras, Javier,Livendahl, Madeleine,McGonigal, Paul R.,Echavarren, Antonio M.. "Gold(I) as an artificial cyclase: Short stereodivergent syntheses of (-)-epiglobulol and (-)-4β,7α- and (-)-4α,7α- aromadendranediols". supporting information. p. 4896 - 4899. Retrieved 2014/05/20.