1,1-Diethoxydecane

Base Information

• Chemical Name: 1,1-Diethoxydecane
• CAS No.: 34764-02-8
• Molecular Formula: C14H30O2
• Molecular Weight: 230.391
• Hs Code.: 2911000000
• European Community (EC) Number: 252-202-5
• NSC Number: 408318
• DSSTox Substance ID: DTXSID30188320
• Nikkaji Number: J104.775B
• Wikidata: Q63393160
• Mol file: 34764-02-8.mol

Synonyms:1,1-Diethoxydecane;Decanal diethyl acetal;34764-02-8;Decane, 1,1-diethoxy-;1,1-Bis(ethyloxy)decane;EINECS 252-202-5;AI3-05097;Decane,1-diethoxy-;NSC408318;1,1-Diethoxydecane #;n-Decanal diethyl acetal;C(OCC)(OCC)CCCCCCCCC;SCHEMBL872866;DTXSID30188320;MFCD00672804;AKOS015838757;NSC 408318;NSC-408318;D5755;Q63393160

Chemical Property of 1,1-Diethoxydecane

Chemical Property:

• Vapor Pressure: 0.0204mmHg at 25°C
• Refractive Index: 1.43
• Boiling Point: 260°Cat760mmHg
• Flash Point: 69°C
• PSA: 18.46000
• Density: 0.844g/cm³
• LogP: 4.52620
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 230.224580195
• Heavy Atom Count: 16
• Complexity: 120

Purity/Quality:

99% ^*data from raw suppliers

Decanal Diethyl Acetal ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC(OCC)OCC

Technology Process of 1,1-Diethoxydecane

There total 8 articles about 1,1-Diethoxydecane 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: 98.0%

caprinaldehyde (112-31-2) + orthoformic acid triethyl ester (122-51-0) → decanal diethyl acetal (34764-02-8)

Guidance literature:

With toluene-4-sulfonic acid; In ethanol; at 20 ℃; for 1h;

DOI:10.1039/c6dt00847j

Reference yield: 95.0%

caprinaldehyde (112-31-2) + trimethyl orthoformate (149-73-5) → decanal diethyl acetal (34764-02-8)

Guidance literature:

indium(III) chloride; In methanol; cyclohexane; for 12h; Heating;

DOI:10.1002/adsc.200303154

Reference yield: 90.0%

caprinaldehyde (112-31-2) + ethanol (64-17-5) → decanal diethyl acetal (34764-02-8) + 1-azido-1-ethoxy-decane (111238-41-6)

Guidance literature:

With hydrogen azide; titanium tetrachloride; In dichloromethane; for 3h; Ambient temperature;

DOI:10.1021/jo00236a006

upstream raw materials:

caprinaldehyde

ethanol

1,1-dimethoxy decane

trimethyl orthoformate

Downstream raw materials:

1,1,3-triethoxy-dodecane

2-dodecenal

tetradeca-2,4-dienal

2-(N,N-dimethylaminomethylidene)decanal

Refernces

• 1、 Ahmed, Basil M.,Calco, Brice,Mezei, Gellert. "Tuning the structure and solubility of nanojars by peripheral ligand substitution, leading to unprecedented liquid-liquid extraction of the carbonate ion from water into aliphatic solvents". . p. 8327 - 8339. Retrieved 2016/06/01.
• 2、 Okuyama, Tadashi,Imamura, Shohei,Ishida, Yoshimi. "Solvolysis of 1-decenyl(phenyl)iodonium tetrafluoroborate: Mechanisms of nucleophilic substitution and elimination". . p. 543 - 548. Retrieved 2007/10/03.