Squalane - ≥95% , CAS No.111-01-3

CAS: 111-01-3 Cat. No.: S141278 分子式: C₃₀H₆₂ 分子量: 422.81 Beilstein Registry Number: 776019 EC番号: 203-825-6

グレード＆純度 ≥95%

Synonyms

squalane-d62 | CAS-111-01-3 | Dodecahydrosqualene | Spinacane | Hexamethyltetracosane | SQUALANE | Robane | Pripure 3759 | Squalane [NF] | Cosbiol | Tetracosane, 2,6,10,15,19,23-hexamethyl- | NSC 6851 | Perhydrosqualene | 2,6,10,15,19,23-Hexamethyltetraco

Storage

Store at 2-8°C

Shipped In

Wet ice

仕様

同義語

squalane-d62 | CAS-111-01-3 | Dodecahydrosqualene | Spinacane | Hexamethyltetracosane | SQUALANE | Robane | Pripure 3759 | Squalane [NF] | Cosbiol | Tetracosane, 2,6,10,15,19,23-hexamethyl- | NSC 6851 | Perhydrosqualene | 2,6,10,15,19,23-Hexamethyltetraco

仕様と純度

≥95%

保管条件

Store at 2-8°C

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥95%

名前と識別子

パブケム・シド

508816568

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/508816568

カノニカル・スマイル

CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

IUPAC Name

2,6,10,15,19,23-hexamethyltetracosane

InChIKey

PRAKJMSDJKAYCZ-UHFFFAOYSA-N

INCHI

1S/C30H62/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h25-30H,9-24H2,1-8H3

異性体SMILES

CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

WGKドイツ

3

RTECS

XB6070000

代替CAS番号

111-01-4

分子量

422.81

Beilstein

776019

Reaxy-Rn

776019

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 分類 Prenol lipids
      • Subclass Triterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 分類: Prenol lipids
• Subclass: Triterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Triterpenoids
• Alternative Parents: Branched alkanes
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Triterpenoid - Branched alkane - Acyclic alkane - Saturated hydrocarbon - Alkane - Hydrocarbon - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
• 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

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in ether, chloroform, benzene, slightly soluble in ethanol, acetone, methanol, insoluble in water
• 屈折率: 1.45-1.452
• 引火点（°F）: 424.4 °F
• 引火点（°C）: 218 °C
• 沸点（°C）: 350 °C
• 融点（°C）: -38 °C
• 分子量: 422.800 g/mol
• XLogP3: 14.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 21
• Exact Mass: 422.485 Da
• Monoisotopic Mass: 422.485 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 308.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 4
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1