Isoamyl ether - ≥98% , CAS No.544-01-4

CAS: 544-01-4 Cat. No.: I100402 Formula: C₁₀H₂₂O Molecular Weight: 158.28 Beilstein Registry Number: 1(4)1682 EC Number: 208-857-4

GRADE & PURITY ≥98%

Synonyms

LS-13910 | Q22829647 | DTXSID8052198 | NCGC00357071-01 | NSC 9281 | Butane, 1,1'-oxybis[3-methyl- | HSDB 2773 | AMY36943 | DTXCID3030769 | EINECS 208-857-4 | ISOAMYL ETHER [MI] | CHEBI:183294 | 3-methyl-1-(3-methylbutoxy)butane | NSC9281 | NSC-9281 | Isop

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Overview

Usually used in the synthesis of silver nanoparticles in a continuous flow tubular microreactor,single-crystal Ag nanocubes (with slight truncation) of around 13.5nm in edge length.

Specifications

Synonyms

LS-13910 | Q22829647 | DTXSID8052198 | NCGC00357071-01 | NSC 9281 | Butane, 1,1'-oxybis[3-methyl- | HSDB 2773 | AMY36943 | DTXCID3030769 | EINECS 208-857-4 | ISOAMYL ETHER [MI] | CHEBI:183294 | 3-methyl-1-(3-methylbutoxy)butane | NSC9281 | NSC-9281 | Isop

Specifications & Purity

≥98%

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488181241
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181241
• Canonical Smiles: CC(C)CCOCCC(C)C
• IUPAC Name: 3-methyl-1-(3-methylbutoxy)butane
• InChIKey: AQZGPSLYZOOYQP-UHFFFAOYSA-N
• INCHI: 1S/C10H22O/c1-9(2)5-7-11-8-6-10(3)4/h9-10H,5-8H2,1-4H3
• Isomeric SMILES: CC(C)CCOCCC(C)C
• WGK Germany: 2
• RTECS: EK5433750
• UN Number: 3271
• Packing Group: III
• Molecular Weight: 158.28
• Beilstein: 1(4)1682
• Reaxy-Rn: 1698014
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1698014&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: 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
• Description: 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

Chemical and Physical Properties

• Solubility: Not soluble in water, but miscible with most organic solvents such as ethanol, ether, chloroform, etc.
• Refractive Index: 1.407
• Flash Point(°F): 114.8 °F
• Flash Point(°C): 46 °C
• Boil Point(°C): 173°C
• Molecular Weight: 158.280 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 158.167 Da
• Monoisotopic Mass: 158.167 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 66.900
• 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

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 544-01-4, the molecular formula is C10H22O, and the molecular weight is 158.28 g/mol. InChIKey AQZGPSLYZOOYQP-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.