Tricosane - ≥98% , CAS No.638-67-5

CAS: 638-67-5 Cat. No.: T108940 分子式: C₂₃H₄₈ 分子量: 324.63 Beilstein Registry Number: 1756000 EC番号: 211-347-4 PubChem CID: 12534

GRADE & PURITY ≥98%

Synonyms

?N-TRICOSANE | EINECS 211-347-4 | TRICOSANE | Docosane, methyl- | Tricosane, 99% | DTXCID5027697 | CH3-[CH2]21-CH3 | Tricosane; NSC 78487; n-Tricosane | D3CD819C-C009-4DE8-8A12-BEFA098575B2 | T166B8R1VC | TRICOSANE [STANDARD MATERIAL FOR GC] | AS-56122 |

Storage

Room temperature

Shipped In

Normal

概要

Two, solid, bilayer phases of the tricosane have been investigated by molecular-dynamics calculations..

Specifications

同義語

?N-TRICOSANE | EINECS 211-347-4 | TRICOSANE | Docosane, methyl- | Tricosane, 99% | DTXCID5027697 | CH3-[CH2]21-CH3 | Tricosane; NSC 78487; n-Tricosane | D3CD819C-C009-4DE8-8A12-BEFA098575B2 | T166B8R1VC | TRICOSANE [STANDARD MATERIAL FOR GC] | AS-56122 |

仕様と純度

≥98%

保管条件

Room temperature

入荷

Normal

純度

≥98%

名前と識別子

• パブケム・シド: 488181694
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/488181694
• カノニカル・スマイル: CCCCCCCCCCCCCCCCCCCCCCC
• IUPAC Name: tricosane
• InChIKey: FIGVVZUWCLSUEI-UHFFFAOYSA-N
• INCHI: 1S/C23H48/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3
• 異性体SMILES: CCCCCCCCCCCCCCCCCCCCCCC
• WGKドイツ: 3
• PubChem CID: 12534
• 分子量: 324.63
• Beilstein: 1756000
• Reaxy-Rn: 1756000

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• 分類: 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
• 説明: 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: an alkane

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

化学的性質と物理的性質

• 溶解度: Insoluble in water.
• 引火点（°F）: 235.4 °F
• 引火点（°C）: 113 °C
• 沸点（°C）: 199-200°C
• 融点（°C）: 46-47°C
• 分子量: 324.600 g/mol
• XLogP3: 12.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 20
• Exact Mass: 324.376 Da
• Monoisotopic Mass: 324.376 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 164.000
• 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

参考文献

1. Jinhao Zhao, Minmin Liang, Zhongyan Wang, Yanyan Zhao, Jingli Cheng, Yongjun Du.  (2022)  Evaluation and optimization of blends for attracting Trichogramma dendrolimi based on semiochemicals mediating tritrophic interactions in the orchard habitat.  BIOLOGICAL CONTROL,      [PMID:] [10.1016/j.biocontrol.2022.104998]

2. Jian Sui, Shi Qi Zhang, Min Zhai, Fang Tian, Jian Zhang, Xiao Zheng Lan.  (2017)  Polymorphism of a hexadecane–heptadecane binary system in nanopores.  RSC Advances,  7  (18): (10737-10747).  [PMID:] [10.1039/C6RA28210E]

よくある質問

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 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 638-67-5, the molecular formula is C23H48, and the molecular weight is 324.63 g/mol. InChIKey FIGVVZUWCLSUEI-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.