Isopropyl ether - ≥99%(GC), contains 100 ppm BHT as stabilizer , CAS No.108-20-3

CAS: 108-20-3 Cat. No.: I110458 Summenformel: C₆H₁₄O Molekulargewicht: 102.17 Beilstein Registry Number: 1731256 EG-Nummer: 203-560-6

GRADE & PURITY ≥99%(GC), contains 100 ppm BHT as stabilizer

Synonyms

Diisopropyl Ether

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

Übersicht

General description

Diisopropyl ether is a colorless liquid. It is widely used as a solvent for the isolation of fats and oils. It can be synthesized from isopropyl alcohol. Its mixture with isooctane has been added to the gasoline fuel as an antiknocking agent. Its synthesis from propylene and water in a single-pass trickle-bed reactor in the presence of an ion-exchange resin catalyst Amberlyst 15 has been proposed.

Application

Diisopropyl ether may be employed as a solvent for the preparation of aliphatic and aromatic cyanohydrins.

Specifications

Synonyme

Diisopropyl Ether

Spezifikationen & Reinheit

≥99%(GC), contains 100 ppm BHT as stabilizer

Storage

Protected from light,Room temperature,Argon charged

Verschickt in

FedEx DG Service

Reinheit

≥99%(GC)

Namen und Kennungen

• Pubchem Sid: 508813449
• Kanonisches Lächeln: CC(C)OC(C)C
• IUPAC Name: 2-propan-2-yloxypropane
• InChIKey: ZAFNJMIOTHYJRJ-UHFFFAOYSA-N
• INCHI: 1S/C6H14O/c1-5(2)7-6(3)4/h5-6H,1-4H3
• Isomere SMILES: CC(C)OC(C)C
• WGK Deutschland: 1
• RTECS: TZ5425000
• UN-Nummer: 1159
• Verpackungsgruppe: II
• Molekulargewicht: 102.17
• Beilstein: 1731256
• Reaxy-Rn: 1731256
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731256&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Löslichkeit: Insoluble in water, can be mixed in alcohol, ether, benzene, chloroform and most other organic solvents.
• Empfindlichkeit: Light &air sensitive.
• Brechungsindex: 1.3678
• Flammpunkt (°C): -28℃
• Siedepunkt (°C): 68-69 °C
• Schmelzpunkt (°C): -60 °C
• Molekulargewicht: 102.170 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 102.104 Da
• Monoisotopic Mass: 102.104 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 33.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referenzen

1. Xirui Kong, Yichen Kong, Lang He, Wenna Zhang, Yi Song, Sheng Liu, Yan Zhao.  (2022)  A new ether-based medium-concentrated electrolyte for lithium–sulfur battery with lean Li anode.  JOURNAL OF POWER SOURCES,      [PMID:] [10.1016/j.jpowsour.2022.232211]

2. Weibin Cai, Haihan Wang, Q. Gary Yang, Tiankun Liu, Yujun Wang.  (2022)  Extracting phenolic compounds from aqueous solutions by cyclohexanone, a highly efficient extractant.  JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY,      [PMID:] [10.1016/j.jiec.2022.09.029]

3. Zhanjun Cheng, Hui Wang, Wenhao Yin, Jinglan Wang, Wei Li, Zhandong Wang, Lili Xing, Xuezhi Gao, Bowen Mei, Yan Zhang, Jiuzhong Yang, Lixia Wei, Xin Zhong, Hu Wang, Yuyang Li, Beibei Yan, Guanyi Chen.  (2021)  Experimental and kinetic modeling study of di-n-propyl ether and diisopropyl ether combustion: Pyrolysis and laminar flame propagation velocity.  COMBUSTION AND FLAME,      [PMID:] [10.1016/j.combustflame.2021.111809]

4. Qingsong Li, Hongyue Guo, Song Lin, Yicong Zhao, Hui Li.  (2021)  Ternary (liquid + liquid) equilibrium experiment and thermodynamic modeling for extraction of diethoxymethane from water with different solvents at 303.2 K under 101.3 kPa.  JOURNAL OF MOLECULAR LIQUIDS,      [PMID:] [10.1016/j.molliq.2021.116793]

5. Jianbing Guo, Jian Wang, Yong He, Hui Sun, Xiaolang Chen, Qiang Zheng, Haibo Xie.  (2020)  Triply Biobased Thermoplastic Composites of Polylactide/Succinylated Lignin/Epoxidized Soybean Oil.  Polymers,  12  (3): (632).  [PMID:32164360] [10.3390/polym12030632]

6. Wei Si, Yanfang Liu, Yuansheng Xiao, Zhimou Guo, Gaowa Jin, Jingyu Yan, Aijin Shen, Han Zhou, Fan Yang, Xinmiao Liang.  (2019)  An offline two-dimensional supercritical fluid chromatography × reversed phase liquid chromatography tandem quadrupole time-of-flight mass spectrometry system for comprehensive gangliosides profiling in swine brain extract.  TALANTA,      [PMID:31816731] [10.1016/j.talanta.2019.120366]

7. Yuping Shen, Man Wang, Yufei Chen, Lili Xu, Yi Lu, Yiying Zhou, James P. Tam, Feng Han, Huan Yang, Xiaobin Jia.  (2018)  Convenient preparation of sagittatoside B, a rare bioactive secondary flavonol glycoside, by recyclable and integrated biphase enzymatic hydrolysis.  ENZYME AND MICROBIAL TECHNOLOGY,      [PMID:30554645] [10.1016/j.enzmictec.2018.12.002]

8. Feng He, Dan Wang, Anyang Wu, Baiyu Jiang, Zhen Zhang, Zhenmei Cheng, Zhisheng Fu, Qisheng Zhang, Zhiqiang Fan.  (2018)  Highly resilient polyethylene elastomers prepared using α-diimine nickel catalyst with highly conjugated backbone.  APPLIED ORGANOMETALLIC CHEMISTRY,  32  (12): (e4566).  [PMID:] [10.1002/aoc.4566]

9. Qingsong Li, Bing Jia, Liping Wang, Mengmeng Yan, Hai Liu, Yingmin Yu.  (2018)  Liquid-liquid equilibrium for ternary systems of water + 2,2,3,3-tetrafluoro-1-propanol + isopropyl ether/tert-butyl methyl ether at 298.2, 308.2 K.  JOURNAL OF CHEMICAL THERMODYNAMICS,      [PMID:] [10.1016/j.jct.2018.04.006]

10. Yirong Feng, Hongbing Song, Meng Xiao, Kaiqiang Lin, Kai Guo, Hengjun Gai.  (2017)  Development of Phenols Recovery process from coal gasification wastewater with mesityl oxide as a novel extractant.  Journal of Cleaner Production,      [PMID:] [10.1016/j.jclepro.2017.08.119]

11. Bing Jia, Chao Zhang, Kun Xin, Yingmin Yu, Qingsong Li.  (2017)  Measurement and Thermodynamic Modeling of Ternary (Liquid + Liquid) Equilibrium for Extraction of N,N-Dimethylacetamide from Aqueous Solution with Different Solvents.  JOURNAL OF CHEMICAL AND ENGINEERING DATA,      [PMID:] [10.1021/acs.jced.7b00194]

12. Wei Heng-yong, Li Hui, Cui Yi, Sang Rong-li, Wang He-yang, Wang Peng, Bu Jing-long, Dong Gui-xia.  (2017)  Synthesis of flexible mullite nanofibres by electrospinning based on nonhydrolytic sol–gel method.  JOURNAL OF SOL-GEL SCIENCE AND TECHNOLOGY,  82  (3): (718-727).  [PMID:] [10.1007/s10971-017-4354-7]

13. Ying Zhang, Xiong Zheng, Maogang He, Lili Liang, Yutian Chen.  (2016)  Speed of sound measurements of di-isopropyl ether (DIPE) from 293.15 K to 673.15 K and up to 10 MPa.  JOURNAL OF CHEMICAL THERMODYNAMICS,      [PMID:] [10.1016/j.jct.2016.09.005]

14. Hui Li, Changmiao Huang, Zixuan Teng, Yushu Luo, Chaocan Zhang, Lili Wu, Wenchao Huang, Tingting Zhao, Lijie Dong, Wanyu Chen.  (2024)  An Ionic Liquid Supramolecular Gel Electrolyte with Unique Wide Operating Temperature Range Properties for Zinc-Ion Batteries.  Polymers,  16  (12): (1680).  [PMID:38932030] [10.3390/polym16121680]

15. Feng He, Dan Wang, Baiyu Jiang, Zhen Zhang, Zhenmei Cheng, Zhisheng Fu, Qisheng Zhang, Zhiqiang Fan.  (2018)  Introducing electron-donating substituents on ligand backbone of α-diimine nickel complex and the effects on catalyst thermal stability in ethylene polymerization.  INORGANICA CHIMICA ACTA,      [PMID:] [10.1016/j.ica.2018.08.048]

16. Gary Q. Yang, Weibin Cai, Tiankun Liu, Yujun Wang, Liangxia Sun.  (2025)  Extraction of Phenolic Compounds with the Highly Efficient Novel Coextractants Cyclohexanone and Methyl Isobutyl Ketone.  ACS Omega,      [PMID:41280843] [10.1021/acsomega.5c03792]