2-Ethoxycyclohexanone

Base Information

• Chemical Name: 2-Ethoxycyclohexanone
• CAS No.: 33371-97-0
• Molecular Formula: C8H14 O2
• Molecular Weight: 142.198
• Hs Code.: 2914509090
• European Community (EC) Number: 625-012-9
• DSSTox Substance ID: DTXSID30369854
• Nikkaji Number: J267.273A
• Mol file: 33371-97-0.mol

Synonyms:2-Ethoxycyclohexanone;33371-97-0;2-ethoxycyclohexan-1-one;ethoxycyclohexanone;LITHIUMIODATE;2-Ethoxy-cyclohexanone;2-Ethoxycyclohexanone, 98%;SCHEMBL930707;DTXSID30369854;WBPWDGRYHFQTRC-UHFFFAOYSA-N;MFCD00015377;AKOS015902966;CS-0332852;FT-0694504;J-019166

Chemical Property of 2-Ethoxycyclohexanone

Chemical Property:

• Vapor Pressure: 0.203mmHg at 25°C
• Refractive Index: n20/D 1.451(lit.)
• Boiling Point: 85 °C15 mm Hg(lit.)
• Flash Point: 130 °F
• PSA: 26.30000
• Density: 1.002 g/mL at 25 °C(lit.)
• LogP: 1.53460
• Storage Temp.: Flammables area
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 142.099379685
• Heavy Atom Count: 10
• Complexity: 120

Purity/Quality:

98%Min ^*data from raw suppliers

(+/-)-2-ETHOXY CYCLOHEXANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 10
• Safety Statements: 16

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1CCCCC1=O

Technology Process of 2-Ethoxycyclohexanone

There total 10 articles about 2-Ethoxycyclohexanone 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: 79.0%

2-Ethoxy-cyclohexanonoxim (10499-40-8) → 2-ethoxycyclohexanone (33371-97-0)

Guidance literature:

With hydrogenchloride; levulinic acid; at 80 ℃; for 3.5h;

Reference yield: 75.0%

ethanol (64-17-5) + cyclohexane-1,2-epoxide (286-20-4) → 2-ethoxycyclohexanone (33371-97-0)

Guidance literature:

With potassium peroxomonosulfate; molybdenum(VI) dichloride dioxide; Heating;

DOI:10.1055/s-2008-1032163

Reference yield: 68.0%

2-hydroxycyclohexanone dimer (60308-50-1,30282-14-5) + ethanol (64-17-5) → 2-ethoxycyclohexanone (33371-97-0)

Guidance literature:

With hydrogenchloride; In diethyl ether; for 24h; Heating;

DOI:10.1016/S0957-4166(97)00456-4

upstream raw materials:

ethanol

cyclohexanone-2-ol

2-Ethoxy-cyclohexanonoxim

2-hydroxycyclohexanone dimer

Downstream raw materials:

2-(1-methyl-1H-indol-3-yl)cyclohexan-1-one

1-ethoxy-2-(hexyloxy)benzene

1,2-dihexyloxybenzene

2-Ethoxyphenol

Refernces

• 1、 Jeyakumar, Kandasamy,Chand, Dillip Kumar. "Ring-opening reactions of epoxides catalyzed by molybdenum(VI) dichloride dioxide". . p. 807 - 819. Retrieved 2008/09/21.
• 2、 Vankar, Yashwant D.,Shah, Kavita,Bawa, Anita,Singh, Surendra P.. "CHEMISTRY OF α-NITROEPOXIDES: SYNTHESIS OF USEFUL INTERMEDIATES VIA NUCLEOPHILIC RING OPENING OF α-NITROEPOXIDES". . p. 8883 - 8906. Retrieved 2007/10/02.