2-Decylfuran

Base Information

• Chemical Name: 2-Decylfuran
• CAS No.: 83469-85-6
• Molecular Formula: C₁₄H₂₄O
• Molecular Weight: 208.344
• UNII: 76WY03R089
• DSSTox Substance ID: DTXSID60232360
• Metabolomics Workbench ID: 45333
• Nikkaji Number: J2.842.574K
• Wikidata: Q27266517
• Mol file: 83469-85-6.mol

Synonyms:2-Decylfuran;83469-85-6;Furan, 2-decyl-;76WY03R089;Furan,2-decyl-;2-decyluran;UNII-76WY03R089;2-DECYLFURAN [FHFI];SCHEMBL5134273;FEMA NO. 4090;DTXSID60232360;CHEBI:168892;PIBKIYYQPWSUDP-UHFFFAOYSA-N;MFCD23135571;NS00124360;E89286;Q27266517

Chemical Property of 2-Decylfuran

Chemical Property:

• Vapor Pressure: 0.011mmHg at 25°C
• Refractive Index: 1.461
• Boiling Point: 271 °C at 760 mmHg
• Flash Point: 112.4 °C
• PSA: 13.14000
• Density: 0.878 g/cm³
• LogP: 4.96280
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 9
• Exact Mass: 208.182715385
• Heavy Atom Count: 15
• Complexity: 133

Purity/Quality:

99.90% ^*data from raw suppliers

2-Decylfuran 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCC1=CC=CO1

Technology Process of 2-Decylfuran

There total 6 articles about 2-Decylfuran 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:

furan (110-00-9) + 1-Decene (872-05-9,17438-89-0,25189-70-2) → 2-decylfuran (83469-85-6) + 2,5-didecylfuran (128912-42-5)

Guidance literature:

With C₃₅H₄₆N₂Ni; sodium t-butanolate; In neat (no solvent); at 100 ℃; for 21h; Overall yield = 73 %; Overall yield = 35.1 mg; Glovebox;

DOI:10.1021/jacs.5b08039

Reference yield:

(E)-1-Hydroxy-tetradec-2-en-4-one (129079-26-1) → 2-decylfuran (83469-85-6)

Guidance literature:

With pyridinium p-toluenesulfonate; trimethyl orthoformate; In dichloromethane; for 2h; Heating;

Reference yield:

(E)-4-hydroxytetradec-2-enal (81335-92-4) → 2-decylfuran (83469-85-6)

Guidance literature:

With pyridinium p-toluenesulfonate; toluene-4-sulfonic acid; In dichloromethane; for 2h; Heating;

upstream raw materials:

furan

1-bromo dodecane

(E)-1-Hydroxy-tetradec-2-en-4-one

(E)-4-hydroxytetradec-2-enal

Refernces

• 1、 McKeown, Neil B.,Chambrier, Isabelle,Cook, Michael J.. "Synthesis and Characterisation of some 1,4,8,11,15,18,22,25-Octa-alkyl- and 1,4,8,11,15,18-Hexa-alkyl-22,25-bis(carboxypropyl)phthalocyanines". . p. 1169 - 1177. Retrieved 2007/10/02.
• 2、 Auria, M. D',Mico, A. De,Piancatelly, G.,Scettry, A.. "A FACILE ROUTE TO 5-ALKYL-2(3H)-FURANONES BY PHOTOISOMERISATION OF ENEDICARBONYL COMPOUNDS". . p. 1661 - 1666. Retrieved 2007/10/02.