11-Formylundeca-4,8-dienoic acid

Base Information

• Chemical Name: 11-Formylundeca-4,8-dienoic acid
• CAS No.: 55348-86-2
• Molecular Formula: C12H18 O3
• Molecular Weight: 210.273
• Hs Code.: 2918300090
• European Community (EC) Number: 259-606-0
• Nikkaji Number: J266.977C
• Mol file: 55348-86-2.mol

Synonyms:11-Formylundeca-4,8-dienoic acid;EINECS 259-606-0;55348-86-2;12-Oxo-4,8-dodecadienoic acid;SCHEMBL11225743;11-formyl-4,8-undecadienoic acid

Chemical Property of 11-Formylundeca-4,8-dienoic acid

Chemical Property:

• Vapor Pressure: 9.33E-07mmHg at 25°C
• Boiling Point: 378°C at 760 mmHg
• PKA: 4.66±0.10(Predicted)
• Flash Point: 196.6°C
• PSA: 54.37000
• Density: 1.021g/cm³
• LogP: 2.72290
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 210.125594432
• Heavy Atom Count: 15
• Complexity: 229

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC=CCCC(=O)O)C=CCCC=O
• Isomeric SMILES: C(C/C=C/CCC(=O)O)/C=C/CCC=O

Technology Process of 11-Formylundeca-4,8-dienoic acid

There total 10 articles about 11-Formylundeca-4,8-dienoic acid 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:

(1E,5E,9Z)-cyclododeca-1,5,9-triene (706-31-0) → 1,8-octa-4-enedial (51097-60-0) + dodeca-4,8-diene-1,12-dialdehyde (55303-96-3) + dodeca-4,8-diene-1,12-dioic acid + 12-oxo-dodeca-4,8-dieneoic acid (55348-86-2)

Guidance literature:

With water; ozone; In tetrahydrofuran; at 2 ℃; for 1.01667h; pH=4.1; Temperature; Solvent;

Reference yield:

(1E,5E,9Z)-cyclododeca-1,5,9-triene (706-31-0) → dodeca-4,8-diene-1,12-dialdehyde (55303-96-3) + dodeca-4,8-diene-1,12-dioic acid + 12-oxo-dodeca-4,8-dieneoic acid (55348-86-2)

Guidance literature:

With water; ozone; In acetic acid methyl ester; at 4.2 ℃; for 0.983333h;

Reference yield:

methanol (67-56-1) + (1E,5E,9Z)-cyclododeca-1,5,9-triene (706-31-0) → dodeca-4,8-diene-1,12-dialdehyde (55303-96-3) + 12-oxododeca-4,8-dieneoic acid methyl ester + 12-oxo-dodeca-4,8-dieneoic acid (55348-86-2)

Guidance literature:

methanol; (1E,5E,9Z)-cyclododeca-1,5,9-triene; With ozone; In acetic acid methyl ester; at 5 ℃; for 1.48333h;

With triethylamine; In acetic acid methyl ester; at 15 - 20 ℃; Molecular sieve;

upstream raw materials:

(1E,5E,9Z)-cyclododeca-1,5,9-triene

methanol

butan-1-ol

tert-butyl alcohol

Downstream raw materials:

1,1-ethylenedioxy-4-O-tosyloxy-7Z,11Z-hexadecadiene

(4Z,8Z)-1,1-dimethoxy-12-tosyloxy-4,8-dodecadiene

Z,Z-7,11-hexadecadienyl alcohol

(7Z,11Z)-7,11-hexadecadien-1-yl acetate