1-Iodohexadecane - ≥97%(GC) , CAS No.544-77-4

CAS: 544-77-4 Cat. No.: I157554 Fórmula: C₁₆H₃₃I Peso molecular: 352.34 Número CE: 208-879-4

GRADE & PURITY ≥97%(GC)

Synonyms

n-Hexadecyl iodide | STL280435 | FT-0607962 | SCHEMBL562180 | 1-Iodohexadecane, contains copper as stabilizer, 95% | 1-IODOHEXADECANE | 1-iodo-hexadecane | Cetyl iodide | DTXCID9029273 | 1-iodanylhexadecane | AKOS006029121 | I0408 | D91141 | Hexadecyl iod

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Visão geral

Product Application：
1-Iodohexadecane was used in the synthesis of alkyl immidazolium surfactants, 1-hexadecyl-imidazolium (Imm-C16) and dihexadecyl-imidazolium (Imm-2C16). It was also used in the chemical synthesis of 1-O-hexadecyl dihydroxyacetone-3-phosphate.

Specifications

Sinónimos

n-Hexadecyl iodide | STL280435 | FT-0607962 | SCHEMBL562180 | 1-Iodohexadecane, contains copper as stabilizer, 95% | 1-IODOHEXADECANE | 1-iodo-hexadecane | Cetyl iodide | DTXCID9029273 | 1-iodanylhexadecane | AKOS006029121 | I0408 | D91141 | Hexadecyl iod

Especificações e pureza

≥97%(GC)

Condições de armazenamento de armazenamento

Store at 2-8°C,Protected from light

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%(GC)

Nomes e identificadores

Pubchem Sid

504752049

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752049

Sorrisos canónicos

CCCCCCCCCCCCCCCCI

IUPAC Name

1-iodohexadecane

InChIKey

KMWHQYDMBYABKL-UHFFFAOYSA-N

INCHI

1S/C16H33I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3

SMILES isoméricas

CCCCCCCCCCCCCCCCI

WGK Alemanha

3

Peso molecular

352.34

Reaxy-Rn

1748533

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1748533&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Organoiodides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Organoiodides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organoiodides
• Alternative Parents: Hydrocarbon derivatives Alkyl iodides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organoiodide - Alkyl iodide - Alkyl halide - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as organoiodides. These are compounds containing a chemical bond between a carbon atom and an iodine atom.
• 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

Propriedades químicas e físicas

• Solubilidade: Insoluble in water.
• Sensibilidade: Light Sensitive
• Índice de refração: 1.48
• Ponto de inflamação (°F): 235.4 °F
• Ponto de inflamação (°C): 113 °C
• Ponto de ebulição (°C): 206-207°C
• Ponto de fusão (°C): 22 °C
• Peso molecular: 352.340 g/mol
• XLogP3: 9.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 14
• Exact Mass: 352.163 Da
• Monoisotopic Mass: 352.163 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 123.000
• 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

Perguntas frequentes

What is the purity of this product, and how is it determined?

This product is supplied at ≥97% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

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 544-77-4, the molecular formula is C16H33I, and the molecular weight is 352.34 g/mol. InChIKey KMWHQYDMBYABKL-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.