Hexatriacontane

Base Information

• Chemical Name: Hexatriacontane
• CAS No.: 630-06-8
• Deprecated CAS: 2040-92-8
• Molecular Formula: C36H74
• Molecular Weight: 506.984
• European Community (EC) Number: 211-127-8
• NSC Number: 407536
• UNII: ZX65M35102
• DSSTox Substance ID: DTXSID7060885
• Nikkaji Number: J94.870E
• Wikipedia: Higher_alkanes
• Wikidata: Q151185
• Metabolomics Workbench ID: 66066
• Mol file: 630-06-8.mol

Synonyms:HEXATRIACONTANE;630-06-8;n-Hexatriacontane;UNII-ZX65M35102;CH3-[CH2]34-CH3;EINECS 211-127-8;NSC 407536;NSC-407536;ZX65M35102;AI3-52389;n-Hexatriacontane 100 microg/mL in Hexane;Hexatriacontane, analytical standard;HEXATRIACONTANE, 98%;Hexatriacontane, n-;DTXSID7060885;CHEBI:72688;HSDB 8364;C36H74;MFCD00009413;NSC407536;AKOS015902574;C36-H74;LS-15387;C(CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC;CS-0197343;FT-0632674;H0120;T72741;Q151185;W-104941;2994BC5D-52BE-44F8-9824-0253A3BD2243

Chemical Property of Hexatriacontane

Chemical Property:

• Appearance/Colour: white shiny flakes
• Vapor Pressure: 1.56E-09mmHg at 25°C
• Melting Point: 74-76 °C(lit. )
• Refractive Index: 1.4573
• Boiling Point: 265 °C 1mm Hg(lit. )
• Flash Point: 497 °C

• PSA: 0.00000
• Density: 0.7795 g/cm³
• LogP: 14.28960
• XLogP3: 19.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 33
• Exact Mass: 506.57905236
• Heavy Atom Count: 36
• Complexity: 312

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Aliphatics, Saturated (>C11)
• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Technology Process of Hexatriacontane

There total 12 articles about Hexatriacontane 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: 47.2%

n-iodooctadecane (629-93-6) → hexatriacontane (630-06-8)

Guidance literature:

With sodium hydroxide; hydrazine hydrate; palladium dichloride; In methanol; for 6h; Heating;

DOI:10.1246/bcsj.54.3599

Reference yield: 39.0%

n-iodooctadecane (629-93-6) → hexatriacontane (630-06-8) + octadecane (593-45-3) + octadec-1-ene (112-88-9)

Guidance literature:

With tetrabutylammonium tetrafluoroborate; In N,N-dimethyl-formamide; Electrochemical reaction; Inert atmosphere;

DOI:10.1016/j.tetlet.2008.12.008

Reference yield:

1-Bromooctadecane (112-89-0) → hexatriacontane (630-06-8)

Guidance literature:

With diethyl ether; sodium;

DOI:10.1021/ja01149a069

upstream raw materials:

n-iodooctadecane

1-octadecylmagnesium bromide

1-Bromooctadecane

nonadecanoic acid

Downstream raw materials:

n-hexatriacontane-d₇₄

Hexatriacontandion-(2.35)

Refernces

• 1、 Poizot, Philippe,Jouikov, Viatcheslav,Simonet, Jacques. "Glassy carbon modified by a silver-palladium alloy: cheap and convenient cathodes for the selective reductive homocoupling of alkyl iodides". body text. p. 822 - 824. Retrieved 2009/05/07.
• 2、 Nakajima, Riichiro,Morita, Kazuhiro,Hara, Tadashi. "The Reductive Coupling of Organic Halide Using Hydrazine and a Palladium Catalyst.II. Homocoupling of 1-Iodoalkanes". . p. 3599 - 3600. Retrieved 2007/10/02.