Pentatriacontane - ≥95%(GC) , CAS No.630-07-9

CAS: 630-07-9 Cat. No.: P160283 分子式: C₃₅H₇₂ 分子量: 492.96 Beilstein Registry Number: 1(4)598 EC番号: 685-675-5 PubChem CID: 12413

GRADE & PURITY ≥95%(GC)

Synonyms

Pentatriacontane, analytical standard | NSC125400 | NSC-125400 | KP13LFH341 | NSC 125400 | UNII-KP13LFH341 | Q151158 | T72742 | Pentatriacontane; NSC 125400; n-Pentatriacontane | VHQQPFLOGSTQPC-UHFFFAOYSA-N | 25E3ABFD-53A7-41A8-9766-C537F92EC7FF | DTXSID9

Storage

Room temperature,Desiccated

Shipped In

Normal

概要

application：

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Specifications

同義語

Pentatriacontane, analytical standard | NSC125400 | NSC-125400 | KP13LFH341 | NSC 125400 | UNII-KP13LFH341 | Q151158 | T72742 | Pentatriacontane; NSC 125400; n-Pentatriacontane | VHQQPFLOGSTQPC-UHFFFAOYSA-N | 25E3ABFD-53A7-41A8-9766-C537F92EC7FF | DTXSID9

仕様と純度

≥95%(GC)

保管条件

Room temperature,Desiccated

入荷

Normal

純度

≥95%(GC)

名前と識別子

• パブケム・シド: 504752335
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/504752335
• カノニカル・スマイル: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
• IUPAC Name: pentatriacontane
• InChIKey: VHQQPFLOGSTQPC-UHFFFAOYSA-N
• INCHI: 1S/C35H72/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-35H2,1-2H3
• 異性体SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
• PubChem CID: 12413
• 分子量: 492.96
• Beilstein: 1(4)598
• Reaxy-Rn: 1711999

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: Hydrocarbons

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

• 沸点（°C）: 331°C/15mmHg(lit.)
• 融点（°C）: 72.0 - 76.0 °C
• 分子量: 492.900 g/mol
• XLogP3: 18.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 32
• Exact Mass: 492.563 Da
• Monoisotopic Mass: 492.563 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 301.000
• 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

よくある質問

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

This product is supplied at ≥95% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store in a cool place, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

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 630-07-9, the molecular formula is C35H72, and the molecular weight is 492.96 g/mol. InChIKey VHQQPFLOGSTQPC-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.