Trimethoxymethyl-cyclohexane

Base Information

• Chemical Name: Trimethoxymethyl-cyclohexane
• CAS No.: 51354-80-4
• Molecular Formula: C10H20O3
• Molecular Weight: 188.267
• Hs Code.: 2909209000
• DSSTox Substance ID: DTXSID40426189
• Wikidata: Q82239156
• Mol file: 51354-80-4.mol

Synonyms:Trimethoxymethyl-cyclohexane;51354-80-4;trimethoxymethylcyclohexane;(TRIMETHOXYMETHYL)CYCLOHEXANE;Cyclohexane,(trimethoxymethyl)-;SCHEMBL11284832;DTXSID40426189;MFCD06858757;AKOS011075398;CS-0238833;EN300-201087

Chemical Property of Trimethoxymethyl-cyclohexane

Chemical Property:

• Boiling Point: 206.3 °C at 760 mmHg
• Flash Point: 71 °C
• PSA: 27.69000
• Density: 0.981 g/cm³
• LogP: 2.15970
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 188.14124450
• Heavy Atom Count: 13
• Complexity: 129

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(C1CCCCC1)(OC)OC

Technology Process of Trimethoxymethyl-cyclohexane

There total 4 articles about Trimethoxymethyl-cyclohexane 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:

1-Acetoxy-cyclohexylcyanid (32379-37-6) → cyclohexanorthocarboxylic acid trimethyl ester (51354-80-4)

Guidance literature:

Multi-step reaction with 4 steps

1: pyrex-glass / 500 °C

2: palladium/SrCO₃; diethyl ether; acetic acid anhydride / Hydrogenation

3: HCl; diethyl ether

With hydrogenchloride; Pd/SrCO₃; diethyl ether; acetic anhydride;

DOI:10.1021/ja01622a040

Reference yield:

cyclohexane carbonitrile (766-05-2) → cyclohexanorthocarboxylic acid trimethyl ester (51354-80-4)

Guidance literature:

Multi-step reaction with 2 steps

1: HCl; diethyl ether

With hydrogenchloride; diethyl ether;

DOI:10.1021/ja01622a040

Reference yield:

cyclohex-1-enecarbonitrile (1855-63-6) → cyclohexanorthocarboxylic acid trimethyl ester (51354-80-4)

Guidance literature:

Multi-step reaction with 3 steps

1: palladium/SrCO₃; diethyl ether; acetic acid anhydride / Hydrogenation

2: HCl; diethyl ether

With hydrogenchloride; Pd/SrCO₃; diethyl ether; acetic anhydride;

DOI:10.1021/ja01622a040

upstream raw materials:

methanol

methyl cyclohexanecarboximidate hydrochloride

1-Acetoxy-cyclohexylcyanid

cyclohexane carbonitrile

Downstream raw materials:

methyl 1-bromocyclohexanecarboxylate

dimethoxymethylene-cyclohexane