(2E,4E)-Deca-2,4-dienyl isovalerate

Base Information

• Chemical Name: (2E,4E)-Deca-2,4-dienyl isovalerate
• CAS No.: 57022-74-9
• Molecular Formula: C₁₅H₂₆O₂
• Molecular Weight: 238.37
• European Community (EC) Number: 260-522-1
• DSSTox Substance ID: DTXSID901211299
• Nikkaji Number: J349.064E,J267.091G
• Mol file: 57022-74-9.mol

Synonyms:57022-74-9;(2E,4E)-Deca-2,4-dienyl isovalerate;EINECS 260-522-1;Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-;Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,Z)-;DTXSID901211299;(2E,4Z)-2,4-Decadienylisovalerate;3-Methylbutanoic acid (2E,4E)-2,4-decadienyl ester

Chemical Property of (2E,4E)-Deca-2,4-dienyl isovalerate

Chemical Property:

• Vapor Pressure: 0.000495mmHg at 25°C
• Boiling Point: 313.5°Cat760mmHg
• Flash Point: 98.4°C
• Density: 0.892g/cm³
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 238.193280068
• Heavy Atom Count: 17
• Complexity: 239

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCC=CC=CCOC(=O)CC(C)C
• Isomeric SMILES: CCCCC/C=C/C=C/COC(=O)CC(C)C

Technology Process of (2E,4E)-Deca-2,4-dienyl isovalerate

There total 17 articles about (2E,4E)-Deca-2,4-dienyl isovalerate 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: 83.0%

(2Z,4Z)-2,4-decadien-1-ol (77657-76-2) + isopentanoyl chloride (108-12-3) → isovaleric acid (2Z,4Z)-2,4-decadienyl ester (57022-74-9)

Guidance literature:

With pyridine; In benzene; at 25 ℃; for 2h;

DOI:10.1002/hlca.19800630832

Reference yield: 82.0%

(2E,4Z)-2,4-decadien-1-ol (16195-71-4) + isopentanoyl chloride (108-12-3) → isovaleric acid (2E,4Z)-2,4-decadienyl ester (56699-32-2,57022-74-9)

Guidance literature:

With pyridine; In benzene; at 25 ℃; for 2h;

DOI:10.1002/hlca.19800630832

Reference yield: 81.0%

(2Z,4E)-deca-2,4-diene-1-ol (77657-81-9) + isopentanoyl chloride (108-12-3) → isovaleric acid (2Z,4E)-2,4-decadienyl ester (57022-74-9)

Guidance literature:

With pyridine; In benzene; at 25 ℃; for 2h;

DOI:10.1002/hlca.19800630832

upstream raw materials:

(2E,4Z)-2,4-decadien-1-ol

isopentanoyl chloride

1-allyl-2-pentylacetylene

deca-1,4c-diene

Refernces