Heptadecane - ≥99%(GC) , CAS No.629-78-7

CAS: 629-78-7 Cat. No.: H104722 Fórmula: C₁₇H₃₆ Peso molecular: 240.47 Beilstein Registry Number: 1738898 Número CE: 211-108-4

GRADE & PURITY ≥99%(GC)

Synonyms

CAS-629-78-7 | NSC 172782 | Heptadecane; NSC 172782; TS 7; n-Heptadecane | HSDB 8347 | C01816 | Heptadecane purum | n-Heptadecane (d36) | Normal-heptadecane | AI3-36898 | DTXCID5027061 | Heptadecane, 99% | Heptadecane, purum, >=98.0% (GC) | Samarium(III)C

Storage

Room temperature

Shipped In

Normal

Visão geral

Heptadecane was used as an internal standard in the reaction to study the first direct comparison of kava lactone extraction efficiencies. It was also used as the appropriate suspended solvent for the extraction and concentration of EO (essential oil).

Specifications

Sinónimos

CAS-629-78-7 | NSC 172782 | Heptadecane; NSC 172782; TS 7; n-Heptadecane | HSDB 8347 | C01816 | Heptadecane purum | n-Heptadecane (d36) | Normal-heptadecane | AI3-36898 | DTXCID5027061 | Heptadecane, 99% | Heptadecane, purum, >=98.0% (GC) | Samarium(III)C

Especificações e pureza

≥99%(GC)

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥99%(GC)

Nomes e identificadores

Pubchem Sid

504752326

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752326

Sorrisos canónicos

CCCCCCCCCCCCCCCCC

IUPAC Name

heptadecane

InChIKey

NDJKXXJCMXVBJW-UHFFFAOYSA-N

INCHI

1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3

SMILES isoméricas

CCCCCCCCCCCCCCCCC

WGK Alemanha

3

RTECS

MI3550000

Peso molecular

240.47

Beilstein

1738898

Reaxy-Rn

1738898

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1738898&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Classe Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyclic alkane - Alkane - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
• External Descriptors: a small molecule

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: Immiscible with water.
• Índice de refração: 1.4369
• Ponto de inflamação (°F): 298.4℉
• Ponto de inflamação (°C): 148℃
• Ponto de ebulição (°C): 301.8°C
• Ponto de fusão (°C): 22°C
• Peso molecular: 240.500 g/mol
• XLogP3: 8.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 14
• Exact Mass: 240.282 Da
• Monoisotopic Mass: 240.282 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 103.000
• 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 ≥99% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 629-78-7, the molecular formula is C17H36, and the molecular weight is 240.47 g/mol. InChIKey NDJKXXJCMXVBJW-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.