(E)-6-Decenal

Base Information

• Chemical Name: (E)-6-Decenal
• CAS No.: 147159-48-6
• Molecular Formula: C₁₀H₁₈O
• Molecular Weight: 154.252
• UNII: ZR7BC83500
• DSSTox Substance ID: DTXSID90888990
• Nikkaji Number: J933.116F,J3.610.408B
• Wikidata: Q27295859
• Metabolomics Workbench ID: 3454
• Mol file: 147159-48-6.mol

Synonyms:(E)-6-Decenal;6-Decenal, (6E)-;trans-6-Decenal;(E)-dec-6-enal;6-decenal;6-Decenal, (E)-;147159-48-6;UNII-ZR7BC83500;ZR7BC83500;LMFA06000056;(6E)-6-decenal;6-decenal,(E)-6-decenal;SCHEMBL10819060;DTXSID90888990;BHAHVSKDYRPNIR-SNAWJCMRSA-N;J3.610.408B;Q27295859

Chemical Property of (E)-6-Decenal

Chemical Property:

• Melting Point: -16°C (estimate)
• Refractive Index: 1.4441 (estimate)
• Boiling Point: 215.1 °C at 760 mmHg
• Flash Point: 79.9 °C
• PSA: 17.07000
• Density: 0.835 g/cm³
• LogP: 3.10200
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 154.135765193
• Heavy Atom Count: 11
• Complexity: 105

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of (E)-6-Decenal

There total 6 articles about (E)-6-Decenal 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: 94.0%

(E)-6-Decen-1-ol (38421-92-0) → (E)-6-decenal (147159-48-6)

Guidance literature:

With Dess-Martin periodane; In dichloromethane; at 0 ℃;

DOI:10.1016/S0040-4020(99)01011-X

Reference yield:

2-(5-bromopentyloxy)tetrahydropyran (37935-47-0) → (E)-6-decenal (147159-48-6)

Guidance literature:

Multi-step reaction with 4 steps

1: 78 percent / BuLi; DMPU / tetrahydrofuran / -78 - 20 °C

2: 98 percent / Na; NH₃ liquid / diethyl ether / -33 °C

3: 94 percent / Alberlyst H-15 / methanol / 45 °C

4: 94 percent / Dess-Martin periodinane / CH₂Cl₂ / 0 °C

With 1,3-dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone; n-butyllithium; Alberlyst H-15; ammonia; sodium; Dess-Martin periodane; In tetrahydrofuran; methanol; diethyl ether; dichloromethane; 1: Substitution / 2: Reduction / 3: Substitution / 4: Oxidation;

DOI:10.1016/S0040-4020(99)01011-X

Reference yield:

5-bromopentan-1-ol (34626-51-2) → (E)-6-decenal (147159-48-6)

Guidance literature:

Multi-step reaction with 5 steps

1: 78 percent / TsOH*H₂O / CH₂Cl₂ / 0 - 25 °C

2: 78 percent / BuLi; DMPU / tetrahydrofuran / -78 - 20 °C

3: 98 percent / Na; NH₃ liquid / diethyl ether / -33 °C

4: 94 percent / Alberlyst H-15 / methanol / 45 °C

5: 94 percent / Dess-Martin periodinane / CH₂Cl₂ / 0 °C

With 1,3-dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone; n-butyllithium; Alberlyst H-15; ammonia; sodium; Dess-Martin periodane; toluene-4-sulfonic acid; In tetrahydrofuran; methanol; diethyl ether; dichloromethane; 1: Addition / 2: Substitution / 3: Reduction / 4: Substitution / 5: Oxidation;

DOI:10.1016/S0040-4020(99)01011-X

upstream raw materials:

(E)-6-Decen-1-ol

orthoformic acid triethyl ester

2-(5-bromopentyloxy)tetrahydropyran

5-bromopentan-1-ol