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589-81-1

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589-81-1 Usage

Chemical Properties

Colorless liquid.

Physical properties

Colorless, flammable liquid with an odor resembling hexane. An odor threshold concentration of 1.5 ppmv was reported by Nagata and Takeuchi (1990).

Uses

Calibration, organic synthesis.

Hazard

Flammable, dangerous fire risk.

Environmental fate

Photolytic. Based on a photooxidation rate constant of 8.90 x 10-12 cm3/molecule?sec for the reaction of 3-methylheptane and OH radicals, the estimated lifetime is 16 h during summer sunlight (Altshuller, 1991). Chemical/Physical. Complete combustion in air produces carbon dioxide and water vapor. 3- Methylheptane will not hydrolyze because it does not contain a hydrolyzable functional group.

Solubility in organics

In methanol, g/L: 154 at 5 °C, 170 at 10 °C, 190 at 15 °C, 212 at 20 °C, 242 at 25 °C, 274 at 30 °C, 314 at 35 °C, 365 at 40 °C (Kiser et al., 1961); miscible in many liquid hydrocarbons, particularly saturated hydrocarbons.

Check Digit Verification of cas no

The CAS Registry Mumber 589-81-1 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 5,8 and 9 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 589-81:
(5*5)+(4*8)+(3*9)+(2*8)+(1*1)=101
101 % 10 = 1
So 589-81-1 is a valid CAS Registry Number.
InChI:InChI=1/C8H18/c1-4-6-7-8(3)5-2/h8H,4-7H2,1-3H3/t8-/m1/s1

589-81-1 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
  • Price
  • Detail
  • Alfa Aesar

  • (L12006)  3-Methylheptane, 97%   

  • 589-81-1

  • 1g

  • 275.0CNY

  • Detail
  • Alfa Aesar

  • (L12006)  3-Methylheptane, 97%   

  • 589-81-1

  • 5g

  • 1038.0CNY

  • Detail
  • Alfa Aesar

  • (L12006)  3-Methylheptane, 97%   

  • 589-81-1

  • 25g

  • 4697.0CNY

  • Detail
  • Aldrich

  • (M47957)  3-Methylheptane  98%

  • 589-81-1

  • M47957-5G

  • 1,074.06CNY

  • Detail

589-81-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-Methylheptane

1.2 Other means of identification

Product number -
Other names Heptane, 3-methyl-

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:589-81-1 SDS

589-81-1Relevant articles and documents

Chemoselective Hydrogenation of Olefins Using a Nanostructured Nickel Catalyst

Klarner, Mara,Bieger, Sandra,Drechsler, Markus,Kempe, Rhett

supporting information, p. 2157 - 2161 (2021/05/21)

The selective hydrogenation of functionalized olefins is of great importance in the chemical and pharmaceutical industry. Here, we report on a nanostructured nickel catalyst that enables the selective hydrogenation of purely aliphatic and functionalized olefins under mild conditions. The earth-abundant metal catalyst allows the selective hydrogenation of sterically protected olefins and further tolerates functional groups such as carbonyls, esters, ethers and nitriles. The characterization of our catalyst revealed the formation of surface oxidized metallic nickel nanoparticles stabilized by a N-doped carbon layer on the active carbon support.

Production of cellulosic gasoline: Via levulinic ester self-condensation

Li, Zheng,Otsuki, Andrew L.,Mascal, Mark

supporting information, p. 3804 - 3808 (2018/08/22)

Most biomass to biofuel processes are limited to the production of linear or minimally branched hydrocarbons. Motor gasoline, however, consists of highly branched linear and/or cyclic alkanes. This work describes the optimization of the levulinic ester self-condensation reaction and the efficient conversion of its products, which are highly branched cyclopentadienes, into a mixture of substituted cyclopentanes with high octane ratings and excellent density and flow properties.

Biobased n-Butanol Prepared from Poly-3-hydroxybutyrate: Optimization of the Reduction of n-Butyl Crotonate to n-Butanol

Schweitzer, Dirk,Mullen, Charles A.,Boateng, Akwasi A.,Snell, Kristi D.

supporting information, p. 710 - 714 (2015/07/27)

Using metabolic engineering approaches, the biopolymer poly-3-hydroxybutyrate (P3HB) can be overproduced in organisms such as bacteria and plants. Thermolysis of P3HB, either in isolated form or within biomass, yields crotonic acid, a potential bioderived platform chemical. Reduction of crotonic acid provides n-butanol, which has value as a fuel and as a commodity chemical. Herein, we report optimization work on the hydrogenation of the n-butyl ester of crotonic acid to n-butanol and the potential of this chemistry to be incorporated into the production of bio-n-butanol from P3HB containing biomass.

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