4-Decenoic acid, (4E)-

Base Information

• Chemical Name: 4-Decenoic acid, (4E)-
• CAS No.: 26303-90-2
• Molecular Formula: C10H18 O2
• Molecular Weight: 170.252
• Hs Code.: 2916190090
• European Community (EC) Number: 260-843-7
• UNII: S0TXC5QGPU
• DSSTox Substance ID: DTXSID50886235
• Nikkaji Number: J39.562E,J98.044G
• Wikidata: Q27288413
• Metabolomics Workbench ID: 466
• Mol file: 26303-90-2.mol

Synonyms:(4Z)-4-decenoic acid;(E)-isomer of 4-decenoic acid;(Z)-isomer of 4-decenoic acid;4-decenoate;4-decenoic acid;4-decenoic acid, (4E)-;cis-4-decenoic acid;cis-dec-4-enoic acid;dec-4-enoic acid;Na-salt, (E)-isomer of 4-decenoic acid;Na-salt, (Z)-isomer of 4-decenoic acid;obtusilic acid;Z-4-decenoic acid

Chemical Property of 4-Decenoic acid, (4E)-

Chemical Property:

• Vapor Pressure: 9.37E-26mmHg at 25°C
• Melting Point: 18.83°C (estimate)
• Refractive Index: 1.4470 to 1.4510
• Boiling Point: 177.8°Cat760mmHg
• PKA: 4.67±0.10(Predicted)
• Flash Point: 65°C
• PSA: 37.30000
• Density: 1.182g/cm³
• LogP: 2.98770
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 170.130679813
• Heavy Atom Count: 12
• Complexity: 139

Purity/Quality:

97% ^*data from raw suppliers

4-Decenoic Acid >98.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-Decenoic acid, (4E)-

There total 1 articles about 4-Decenoic acid, (4E)- 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:

(+/-)-δ-decanolactone (705-86-2) → 5(6)-decenoic acid (85392-03-6) + 5-hexyldihydro-2(3H)-furanone (706-14-9,2825-92-5) + 6-decenoic acid (85392-04-7) + 4-decenoic acid (26303-90-2)

Guidance literature:

With active clay; at 170 ℃; for 5h;

DOI:10.1271/bbb.69.2416

Reference yield:

8-amino quinoline (578-66-5) + 4-decenoic acid (26303-90-2) → 5-phenyl-N-(quinolin-8-yl)decanamide

Guidance literature:

Multi-step reaction with 2 steps

1: pyridine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / dichloromethane / 20 °C

2: bis(η3-allyl-μ-chloropalladium(II)); N–phenyl–2–(dicyclohexylphosphino)pyrrole; water; 2.3-butanediol; cyanoacetic acid; caesium carbonate / 18 h / 130 °C / Inert atmosphere; Schlenk technique; Sealed tube

With pyridine; bis(η3-allyl-μ-chloropalladium(II)); water; caesium carbonate; cyanoacetic acid; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; N–phenyl–2–(dicyclohexylphosphino)pyrrole; 2.3-butanediol; In dichloromethane;

DOI:10.1021/acs.orglett.9b04474

upstream raw materials:

(+/-)-δ-decanolactone