9,12-Tetradecadien-1-ol, acetate

Base Information

• Chemical Name: 9,12-Tetradecadien-1-ol, acetate
• CAS No.: 30507-70-1
• Molecular Formula: C16H28 O2
• Molecular Weight: 252.397
• Hs Code.: 2915390090
• European Community (EC) Number: 250-753-6,608-490-3
• UNII: RL6YJY2D5H
• Nikkaji Number: J671H,J675K,J213.440C
• Metabolomics Workbench ID: 3942
• Mol file: 30507-70-1.mol

Synonyms:cis-9-trans-12-tetradecadien-1-ol acetate;cis-9-trans-12-tetradecadien-1-ol acetate, (E,Z)-isomer

Chemical Property of 9,12-Tetradecadien-1-ol, acetate

Chemical Property:

• Refractive Index: 1.4565 (25℃)
• Boiling Point: 334.8°Cat760mmHg
• Flash Point: 102.3°C
• PSA: 40.13000
• Density: 0.89g/cm³
• LogP: 3.76960
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 252.208930132
• Heavy Atom Count: 18
• Complexity: 242

Purity/Quality:

99.9% ^*data from raw suppliers

(9Z,12E)-Tetradecadien-1-olAcetate ^*data from reagent suppliers

Safty Information:

• Safety Statements: Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.:

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CCC=CCCCCCCCCOC(=O)C
• Isomeric SMILES: C/C=C/C/C=C/CCCCCCCCOC(=O)C
• Uses: (9Z,12E)-Tetradecadien-1-ol Acetate can be used in agricultural use and biological study for method and pesticidal mixtures for controlling Pentatomidae pests.

Technology Process of 9,12-Tetradecadien-1-ol, acetate

There total 65 articles about 9,12-Tetradecadien-1-ol, acetate 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: 93.0%

Tetradeca-cis-9,trans-12-dien-1-ol (42521-46-0,51937-00-9) + acetyl chloride (75-36-5) → Tetradec-9Z,12E-dien-1-yl Acetate (30507-70-1)

Guidance literature:

With pyridine; In tetrahydrofuran;

DOI:10.1007/bf02757427

Reference yield: 89.0%

Tetradeca-cis-9,trans-12-dien-1-ol (42521-46-0,51937-00-9) + acetic anhydride (108-24-7) → Tetradec-9Z,12E-dien-1-yl Acetate (30507-70-1) + (Z)-undec-9-en-1-ol (58257-52-6)

Guidance literature:

With pyridine; In dichloromethane; at 20 ℃; for 18h; chemoselective reaction; Inert atmosphere;

DOI:10.1002/anie.201206079

Reference yield: 85.0%

(E)-12-tetradec-9-yn-12-en-1-yl acetate (71394-01-9) → Tetradec-9Z,12E-dien-1-yl Acetate (30507-70-1)

Guidance literature:

With hydrogen; sodium tetrahydroborate; nickel diacetate; ethylenediamine; In ethanol; Ambient temperature;

DOI:10.1007/BF00629770

upstream raw materials:

9-acetoxynonal

((E)-Pent-3-enylidene)-triphenyl-λ⁵-phosphane

1-<(tetrahydro-2H-pyran-2-yl)oxy> 9Z, 12E-tetradecadiene

(Z,E)-9,12-tetradecadien-1-ol

Downstream raw materials:

Tetradeca-cis-9,trans-12-dien-1-ol

Refernces

• 1、 -. "Method for synthesizing (9Z, 12E)-9,12-tetradecadien-1-ol acetate". Paragraph 0011; 0042-0044. . Retrieved 2020/06/16.
• 2、 Weber, Felicia,Schmidt, Anastasia,R?se, Philipp,Fischer, Michel,Burghaus, Olaf,Hilt, Gerhard. "Double-Bond Isomerization: Highly Reactive Nickel Catalyst Applied in the Synthesis of the Pheromone (9 Z,12 Z)-Tetradeca-9,12-dienyl Acetate". supporting information. p. 2952 - 2955. Retrieved 2015/06/30.