Methylcyclooctane

Base Information

• Chemical Name: Methylcyclooctane
• CAS No.: 1502-38-1
• Molecular Formula: C₉H₁₈
• Molecular Weight: 126.242
• Hs Code.: 2902199090
• DSSTox Substance ID: DTXSID20164491
• Nikkaji Number: J1.333.781K
• Wikidata: Q83033566
• Mol file: 1502-38-1.mol

Synonyms:METHYLCYCLOOCTANE;1502-38-1;Cyclooctane, methyl-;methyl cyclooctane;DTXSID20164491;POCNHGFJLGYFIK-UHFFFAOYSA-N;AKOS006273260;FT-0693606

Chemical Property of Methylcyclooctane

Chemical Property:

• Vapor Pressure: 2.9mmHg at 25°C
• Melting Point: 14.85°C
• Refractive Index: 1.4640 (estimate)
• Boiling Point: 161.9°Cat760mmHg
• Flash Point: 37.7°C
• PSA: 0.00000
• Density: 0.779g/cm³
• LogP: 3.36680
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 126.140850574
• Heavy Atom Count: 9
• Complexity: 58.4

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCCCCCC1

Technology Process of Methylcyclooctane

There total 20 articles about Methylcyclooctane 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:

bicyclo[6.1.0]nonane (286-60-2) → methylcyclooctane (1502-38-1)

Guidance literature:

With hydrogen; platinum; In acetic acid; at 150 ℃; for 21h; under 110326 Torr;

Reference yield:

cis-Cyclooctene (931-88-4,931-87-3,25267-51-0) → methylcyclooctane (1502-38-1)

Guidance literature:

Multi-step reaction with 2 steps

1: Zn-Cu, I₂ / diethyl ether / 96 h / Heating

2: (i) HCO₂H, (ii) aq. NaOH, (iii) H₂, Pd-C, AcOH

With iodine; copper; zinc; In diethyl ether;

DOI:10.1021/ja00905a016

Reference yield:

3-Vinyl-1.4-cyclooctadien (36399-01-6) → methylcyclooctane (1502-38-1)

Guidance literature:

With hydrogen; platinum(IV) oxide; In diethyl ether;

DOI:10.1021/jo00900a005

upstream raw materials:

methylcyclooctene

Methylcyclooctatetraen

cis-bicyclo[6.1.0]nonane

1-Methyl-1,5-cyclooctadien