1-Carbomethoxy-1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene

Base Information

• Chemical Name: 1-Carbomethoxy-1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene
• CAS No.: 21280-30-8
• Deprecated CAS: 146918-70-9
• Molecular Formula: C15H24O2
• Molecular Weight: 236.354
• DSSTox Substance ID: DTXSID90275861,DTXSID90885166
• Nikkaji Number: J24.352C
• Mol file: 21280-30-8.mol

Synonyms:21280-30-8;1-Carbomethoxy-1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene;1-Methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxylic acid methyl ester;3-Cyclohexene-1-carboxylic acid, 1-methyl-4-(4-methyl-3-penten-1-yl)-, methyl ester;3-Cyclohexene-1-carboxylic acid, 1-methyl-4-(4-methyl-3-pentenyl)-, methyl ester;DTXSID90275861;DTXSID90885166;146918-70-9

Chemical Property of 1-Carbomethoxy-1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene

Chemical Property:

• Vapor Pressure: 0.00155mmHg at 25°C
• Boiling Point: 295.1°C at 760 mmHg
• Flash Point: 124.8°C
• PSA: 26.30000
• Density: 0.942g/cm³
• LogP: 4.02240
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 236.177630004
• Heavy Atom Count: 17
• Complexity: 335

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC1=CCC(CC1)(C)C(=O)OC)C

Technology Process of 1-Carbomethoxy-1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene

There total 3 articles about 1-Carbomethoxy-1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene 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:

7-methyl-3-methene-1,6-octadiene (123-35-3) + methacrylic acid methyl ester (80-62-6,114512-63-9,143476-91-9,25188-98-1,9011-14-7) → methyl ester of 1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxylic acid (21280-30-8) + methyl ester of 1-methyl-3-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxylic acid (65652-28-0)

Guidance literature:

Yield given. Yields of byproduct given; Heating;

DOI:10.1246/cl.1993.29

Reference yield:

7-methyl-3-methene-1,6-octadiene (123-35-3) + methacrylic acid methyl ester (80-62-6,114512-63-9,143476-91-9,25188-98-1,9011-14-7) → methyl ester of 1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxylic acid (21280-30-8)

Guidance literature:

Reference yield:

→ methyl ester of 1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxylic acid (21280-30-8)

Guidance literature:

Myrcen, Methylmethacrylat;

upstream raw materials:

7-methyl-3-methene-1,6-octadiene

methacrylic acid methyl ester

Downstream raw materials:

methyl ester of 2,8,8-trimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-carboxylic acid

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