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2,6-DIMETHYLOCTANE, also known as Myrcane, is a branched alkane hydrocarbon with the molecular formula C10H22. It is a colorless liquid at room temperature and is commonly used as a synthetic intermediate in the chemical industry due to its unique structural properties.

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  • 2051-30-1 Structure
  • Basic information

    1. Product Name: 2,6-DIMETHYLOCTANE
    2. Synonyms: 2,6-DIMETHYLOCTANE;dimethyloctane;Octane, 2,6-dimethyl-;octane,2,6-dimethyl-;tetrahydrocitronellene;2,6-DIMETHYLOCTANE 95+%
    3. CAS NO:2051-30-1
    4. Molecular Formula: C10H22
    5. Molecular Weight: 142.28
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 2051-30-1.mol
  • Chemical Properties

    1. Melting Point: -53.15°C
    2. Boiling Point: 158°C
    3. Flash Point: 34°C
    4. Appearance: /
    5. Density: 0,73 g/cm3
    6. Vapor Pressure: 3.21mmHg at 25°C
    7. Refractive Index: 1.3990-1.4130
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. Water Solubility: 89.16ug/L(temperature not stated)
    11. CAS DataBase Reference: 2,6-DIMETHYLOCTANE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 2,6-DIMETHYLOCTANE(2051-30-1)
    13. EPA Substance Registry System: 2,6-DIMETHYLOCTANE(2051-30-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: 10
    3. Safety Statements: 16
    4. RIDADR: 3295
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: 3
    8. PackingGroup: III
    9. Hazardous Substances Data: 2051-30-1(Hazardous Substances Data)

2051-30-1 Usage

Uses

Used in Chemical Synthesis:
2,6-DIMETHYLOCTANE is used as a synthetic intermediate for the production of various alcohols via C-H hydroxylation of alicyclic and aliphatic compounds. Its unique branching pattern allows for selective functionalization, making it a valuable building block in the synthesis of complex organic molecules.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, 2,6-DIMETHYLOCTANE can be used as a starting material for the synthesis of various drug molecules. Its ability to undergo selective functionalization makes it a versatile component in the development of new therapeutic agents.
Used in Petrochemical Industry:
2,6-DIMETHYLOCTANE can also be utilized in the petrochemical industry as a component in the production of fuels and lubricants. Its high branching and low pour point make it a desirable additive for improving the performance characteristics of these products.
Used in Flavor and Fragrance Industry:
Due to its unique odor profile, 2,6-DIMETHYLOCTANE can be employed in the flavor and fragrance industry as a component in the creation of various scents and flavors. Its ability to mimic natural aromas makes it a valuable asset in the development of new fragrances and flavor compounds.
Used in Research and Development:
In academic and industrial research settings, 2,6-DIMETHYLOCTANE serves as a model compound for studying various chemical reactions and processes. Its well-defined structure and reactivity make it an ideal candidate for investigating reaction mechanisms and developing new synthetic methodologies.

Check Digit Verification of cas no

The CAS Registry Mumber 2051-30-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,0,5 and 1 respectively; the second part has 2 digits, 3 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 2051-30:
(6*2)+(5*0)+(4*5)+(3*1)+(2*3)+(1*0)=41
41 % 10 = 1
So 2051-30-1 is a valid CAS Registry Number.
InChI:InChI=1/C10H22/c1-5-10(4)8-6-7-9(2)3/h9-10H,5-8H2,1-4H3

2051-30-1 Well-known Company Product Price

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  • TCI America

  • (D1212)  2,6-Dimethyloctane  >90.0%(GC)

  • 2051-30-1

  • 1mL

  • 1,240.00CNY

  • Detail

2051-30-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,6-DIMETHYLOCTANE

1.2 Other means of identification

Product number -
Other names Octane,2,6-dimethyl

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:2051-30-1 SDS

2051-30-1Relevant articles and documents

The formation features of C10–C20 regular petroleum isoprenanes

Gordadze,Giruts,Poshibaeva,Koshelev

, p. 672 - 676 (2016/10/04)

To model the formation processes of C10–C20 petroleum isoprenanes, thermolysis of regular and irregular C20–C40 isoprenanes (phytane, crocetane, squalane, and lycopane) and the suggested precursors of regular pe

Catalytic Production of Branched Small Alkanes from Biohydrocarbons

Oya, Shin-Ichi,Kanno, Daisuke,Watanabe, Hideo,Tamura, Masazumi,Nakagawa, Yoshinao,Tomishige, Keiichi

, p. 2472 - 2475 (2015/08/24)

Squalane, C30 algae-derived branched hydrocarbon, was successfully converted to smaller hydrocarbons without skeletal isomerization and aromatization over ruthenium on ceria (Ru/CeO2). The internal CH2-CH2 bonds located between branches are preferably dissociated to give branched alkanes with very simple distribution as compared with conventional methods using metal-acid bifunctional catalysts.

High-performance ring-opening catalysts based on iridium-containing zeolite Beta in the hydroconversion of decalin

Santi, Dominic,Holl, Tobias,Calemma, Vincenzo,Weitkamp, Jens

, p. 46 - 57 (2013/06/04)

Decalin was converted in a flow-type reactor under a hydrogen pressure of 5.2 MPa on Ir/H,A-Beta zeolite catalysts, where A stands for an alkali metal cation. In one series of catalysts, the Ir content was 3 wt.%, and the nature of A was varied from lithi

Study on selectivity of β-myrcene hydrogenation in high-pressure carbon dioxide catalysed by noble metal catalysts

Bogel-Lukasik,Gomes Da Silva,Nogueira,Bogel-Lukasik,Nunes Da Ponte

experimental part, p. 1847 - 1856 (2011/03/19)

Hydrogenation of monoterpenes, such as β-myrcene, in high-density carbon dioxide over 0.5 wt.% Pd, or Rh, or Ru supported on alumina was investigated. Hydrogenation catalysed by Rh and Ru is generally faster in a single supercritical (sc) phase (gaseous reagents and solid catalyst) than in a biphasic system (liquid + gas reactants + solid catalyst). The reaction catalysed by Pd occurs faster in two phases. The final composition of the reaction mixture is strongly dependent on the noble metal catalyst used for the reaction. Palladium gives mainly 2,6-dimethyloctane (≈95%), rhodium produces 2,6-dimethyloctane with a yield higher than 40%, and around 40% of 2,6-dimethyloct-2-ene, while ruthenium gives around 10% of 2,6-dimethyloctane and 50% of 2,6-dimethyloct-2-ene leaving the highest amount of unreacted β-myrcene. The Pd catalyst is highly active with an excellent selectivity in enabling the one-pot synthesis of 2,6-dimethyloctane through β-myrcene hydrogenation in the presence of scCO2. The overall activity of the noble metal catalysts decreased in the order Pd > Rh > Ru. The problem of leaching of the active metal from the catalyst rod was also investigated. The Royal Society of Chemistry 2009.

Two-stage Reduction of Carbon Dioxide by Hydrogen in a Discharge and in the Presence of a Cobalt-Zirconium Catalyst Deposited on Kieselguhr

Eremin, E. N.,Rubstsova, E. A.,Ivanter, V. I.,Belova, V. M.

, p. 1722 - 1724 (2007/10/02)

The reduction of carbon dioxide by hydrogen has been investigated in a circulation system at a pressure of 1066 GPa, for discharge parameters of 1.9 kV and 150 mA, and at a temperature of 190 to 195 deg C in the catalytic reactor.The overall rate of the reaction was determined by the rate of its catalytic stage; for a contact time between the gas and the catalyst shorter than 3 s, the reaction is displaced towards the formation of paraffinic hydrocarbons.The qualitative and quantitative compositions of the liquid phase depended on its condensation conditions.At positive condensation temperatures, a condensate with relatively heavy components was obtained, up to 60-80percent of which consisted of C9H20-C12 H26 hydrocarbons.Their predominance in the condensate can be explained by secondary reactions on the catalyst involving relatively light saturated hydrocarbons.

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