1-Octacosanol - ≥95% , CAS No.557-61-9

CAS: 557-61-9 Cat. No.: O165300 Summenformel: C₂₈H₅₈O Molekulargewicht: 410.76 EG-Nummer: 209-181-2

QUALITÄT & REINHEIT ≥95%

Synonyms

F17671 | O0199 | s5161 | 81I2215OVK | DTXSID1025803 | NCGC00274075-01 | OCTACOSANOL,95% | OCTACOSANOL [WHO-DD] | EINECS 209-181-2 | Octacosan-1-ol | Q3631024 | C08387 | O8N | Cluytyl alcohol | SCHEMBL16043 | A830795 | HY-N6811 | AS-14389 | OCTACOSANOL (CO

Storage

Store at 2-8°C

Shipped In

Wet ice

Spezifikationen

Synonyme

F17671 | O0199 | s5161 | 81I2215OVK | DTXSID1025803 | NCGC00274075-01 | OCTACOSANOL,95% | OCTACOSANOL [WHO-DD] | EINECS 209-181-2 | Octacosan-1-ol | Q3631024 | C08387 | O8N | Cluytyl alcohol | SCHEMBL16043 | A830795 | HY-N6811 | AS-14389 | OCTACOSANOL (CO

Spezifikationen & Reinheit

≥95%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504754288

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754288

Kanonisches Lächeln

CCCCCCCCCCCCCCCCCCCCCCCCCCCCO

IUPAC Name

octacosan-1-ol

InChIKey

CNNRPFQICPFDPO-UHFFFAOYSA-N

INCHI

1S/C28H58O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29/h29H,2-28H2,1H3

Isomere SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCO

WGK Deutschland

3

Molekulargewicht

410.76

Reaxy-Rn

1786879

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1786879&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Klasse Fatty Acyls
      • Subclass Fatty alcohols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.
• External Descriptors: a long-chain alcohol - a primary alcohol - a fatty alcohol

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

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 83°C
• Molekulargewicht: 410.800 g/mol
• XLogP3: 13.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 26
• Exact Mass: 410.449 Da
• Monoisotopic Mass: 410.449 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 29
• Formal Charge: 0
• Complexity: 263.000
• 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