trans-Lachnophyllol

Base Information

• Chemical Name: trans-Lachnophyllol
• CAS No.: 23180-62-3
• Molecular Formula: C₁₀H₁₂O
• Molecular Weight: 148.205
• DSSTox Substance ID: DTXSID001310600
• Nikkaji Number: J2.364.839C,J82.054G
• Wikidata: Q27155349
• Mol file: 23180-62-3.mol

Synonyms:trans-Lachnophyllol;23180-62-3;2-Decene-4,6-diyn-1-ol, (E)-;2-Decene-4,6-diyne-1-ol;CHEBI:81417;DTXSID001310600;(2E)-2-Decene-4,6-diyn-1-ol;C17965;Q27155349

Chemical Property of trans-Lachnophyllol

Chemical Property:

• Vapor Pressure: 0.000176mmHg at 25°C
• Boiling Point: 294°C at 760 mmHg
• Flash Point: 136.9°C
• PSA: 20.23000
• Density: 0.979g/cm³
• LogP: 1.34180
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 148.088815002
• Heavy Atom Count: 11
• Complexity: 235

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC#CC#CC=CCO
• Isomeric SMILES: CCCC#CC#C/C=C/CO

Technology Process of trans-Lachnophyllol

There total 6 articles about trans-Lachnophyllol 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: 50.0%

(2E)-3-iodo-2-propen-1-ol (37428-50-5,71065-45-7,37428-57-2) + (Z)-1-chlorohept-1-en-3-yne (156542-93-7) → (E)-2-decen-4,6-diyn-1-ol (91060-73-0,23180-62-3) + 4,6,8,10-tetradecatetrayne

Guidance literature:

(Z)-1-chlorohept-1-en-3-yne; With trimethyltin(IV)chloride; lithium diisopropyl amide; In diethyl ether; hexane; at -80 - 0 ℃;

(2E)-3-iodo-2-propen-1-ol; With bis(benzonitrile)palladium(II) dichloride; In N,N-dimethyl-formamide; at 0 ℃; for 2.5h;

DOI:10.1016/S0040-4020(99)01030-3

Reference yield:

dec-2-ene-4,6-diynal (99058-77-2) → (E)-2-decen-4,6-diyn-1-ol (91060-73-0,23180-62-3)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 20 ℃; for 0.166667h;

DOI:10.1002/chem.201103325

Reference yield:

pentynyl bromide (14752-60-4) + (E)-2-penten-4-yn-1-ol (35042-52-5) → (E)-2-decen-4,6-diyn-1-ol (91060-73-0,23180-62-3)

Guidance literature:

With ethylamine; copper(l) chloride;

upstream raw materials:

1-Pentyne

(E)-2-penten-4-yn-1-ol

pentynyl bromide

(2E)-3-iodo-2-propen-1-ol

Downstream raw materials:

C₁₈H₁₆O₂

(E)-2-decen-4,6-diynoic acid