Nonatriacontane

Base Information

• Chemical Name: Nonatriacontane
• CAS No.: 7194-86-7
• Molecular Formula: C39H80
• Molecular Weight: 549.064
• European Community (EC) Number: 686-233-4
• UNII: ZOH3A3X6UH
• DSSTox Substance ID: DTXSID4074724
• Nikkaji Number: J276.889E
• Wikidata: Q151226
• Mol file: 7194-86-7.mol

Synonyms:Nonatriacontane;7194-86-7;n-Nonatriacontane;ZOH3A3X6UH;n-Nonatriacontane 100 microg/mL in Hexane;UNII-ZOH3A3X6UH;DTXSID4074724;Nonatriacontane, >=90.0% (GC);FT-0728160;Q151226

Chemical Property of Nonatriacontane

Chemical Property:

• Vapor Pressure: 2.67E-10mmHg at 25°C
• Melting Point: 78-82 °C
• Refractive Index: 1.4705 (estimate)
• Boiling Point: 517.5°C at 760 mmHg
• Flash Point: 397.5°C
• PSA: 0.00000
• Density: 0.816g/cm³
• LogP: 15.45990
• Storage Temp.: Room Temperature
• Solubility.: Chloroform (Sparingly), Hexanes (Slightly)
• XLogP3: 20.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 36
• Exact Mass: 548.62600255
• Heavy Atom Count: 39
• Complexity: 350

Purity/Quality:

98%,99%, ^*data from raw suppliers

Nonatriacontane ≥90.0% (GC) ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
• Uses: Nonatriacontane was identified in a comparison between the chemical composition of PM2.5 emissions from traditional versus advanced combustion (semi-?gasifier) solid fuel stoves. It is a pollutant. Nonatriacontane was used to develop a new peak alignment algorithm named distance and spectrum correlation optimization (DISCO) method to align two-dimensional gas chromatography time-of-flight mass spectrometry data for metabolomics.

Technology Process of Nonatriacontane

There total 1 articles about Nonatriacontane 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:

→ n-nonatriacontane (7194-86-7)

Guidance literature:

With hydrogenchloride; amalgamated zinc; acetic acid;

DOI:10.1021/ja01233a512