1,1-Dimethoxydecane

Base Information

• Chemical Name: 1,1-Dimethoxydecane
• CAS No.: 7779-41-1
• Molecular Formula: C12H26 O2
• Molecular Weight: 202.337
• Hs Code.: 2911000000
• European Community (EC) Number: 231-928-6
• NSC Number: 46132
• UNII: 9JJ0AU8EKL
• DSSTox Substance ID: DTXSID3064803
• Nikkaji Number: J60.726F
• Wikidata: Q27272633
• Metabolomics Workbench ID: 47745
• Mol file: 7779-41-1.mol

Synonyms:1,1-Dimethoxydecane;Decanal dimethyl acetal;7779-41-1;Decane, 1,1-dimethoxy-;Decylaldehyde DMA;Decanal, dimethyl acetal;Decylaldehyde dimethyl acetal;Capraldehyde dimethyl acetal;Aldehyde C-10 dimethylacetal;10,10-Dimethoxydecane;DECANAL, DIMETHYLACETAL;FEMA No. 2363;n-Decanal dimethyl acetal;EINECS 231-928-6;UNII-9JJ0AU8EKL;NSC 46132;9JJ0AU8EKL;Decylaldehyde dimethylacetal;BRN 4242149;AI3-36022;NSC-46132;Decane,1-dimethoxy-;1,1-Dimethoxy-Decane;1,1 - dimethoxydecane;SCHEMBL531066;DTXSID3064803;Decanal, dimethyl acetal (8CI);FEMA 2363;CHEBI:178468;Decanal dimethyl acetal, >=98%;NSC46132;AKOS015901961;DECANAL DIMETHYL ACETAL [FHFI];LS-2654;FT-0690782;Q27272633

Chemical Property of 1,1-Dimethoxydecane

Chemical Property:

• Vapor Pressure: 0.0906mmHg at 25°C
• Refractive Index: n20/D 1.424(lit.)
• Boiling Point: 218 ºC
• Flash Point: 93 ºC
• PSA: 18.46000
• Density: 0.83
• LogP: 3.74600
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 202.193280068
• Heavy Atom Count: 14
• Complexity: 101

Purity/Quality:

99% ^*data from raw suppliers

1,1-Dimethoxydecane ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,N
• Statements: 38-51/53
• Safety Statements: 36-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC(OC)OC

Technology Process of 1,1-Dimethoxydecane

There total 5 articles about 1,1-Dimethoxydecane 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%

methanol (67-56-1) + caprinaldehyde (112-31-2) → 1,1-dimethoxy decane (7779-41-1)

Guidance literature:

With N-chloro-succinimide; thiourea; at 23 ℃; for 0.75h;

DOI:10.1016/j.tetlet.2009.01.006

Reference yield: 90.0%

methanol (67-56-1) + caprinaldehyde (112-31-2) → 1,1-dimethoxy decane (7779-41-1) + 1-azido-1-methoxydecane (111238-40-5)

Guidance literature:

With hydrogen azide; titanium tetrachloride; In dichloromethane; for 3h; Yields of byproduct given; Ambient temperature;

DOI:10.1021/jo00236a006

Reference yield: 85.0%

caprinaldehyde (112-31-2) + trimethyl orthoformate (149-73-5) → 1,1-dimethoxy decane (7779-41-1)

Guidance literature:

With zinc(II) chloride; In methanol; cyclohexane; for 9h; Reflux;

DOI:10.1080/00397910802412859

upstream raw materials:

methanol

caprinaldehyde

trimethyl orthoformate

1-Decene

Downstream raw materials:

decanal diethyl acetal

1-azido-1-ethoxy-decane

2-n-nonyl-1,3-dioxolane

C₉H₁₀O₃

Refernces

• 1、 Kawajiri, Takahiro,Kato, Maho,Nakata, Hiroki,Goto, Ryota,Aibara, Shin-Yo,Ohta, Reiya,Fujioka, Hiromichi,Sajiki, Hironao,Sawama, Yoshinari. "Chemoselective Nucleophilic Functionalizations of Aromatic Aldehydes and Acetals via Pyridinium Salt Intermediates". . p. 3853 - 3870. Retrieved 2019/03/07.
• 2、 Zhu, Yi-Wei,Yi, Wen-Bin,Cai, Chun. "A recyclable fluorous hydrazine-1,2-bis(carbothioate) with NCS as efficient catalysts for acetalization of aldehydes". supporting information. p. 890 - 892. Retrieved 2013/07/05.