1-Eicosanol - ≥95%(GC) , CAS No.629-96-9

CAS: 629-96-9 Cat. No.: I135869 Molecular Weight: 298.56 Beilstein Registry Number: 1431 EC Number: 211-119-4

GRADE & PURITY ≥95%(GC)

Synonyms

EICOSANOL | N-1-Eicosanol | EC 211-119-4 | Icosan-1-ol | SCHEMBL108302 | 1-Eicosanol, purum, >=97.0% (GC) | E0004 | H10676 | Pri-N-eicosyl alcohol | 1QR1QRA9BU | Arachidyl alcohol, United States Pharmacopeia (USP) Reference Standard | eicosan-1-ol | HSDB

Storage

Room temperature

Shipped In

Normal

Application

Drug Delivery, Surface Modification, PEGylation of Protein, Peptide & Oligo

Overview

The polymorphism of 1-eicosanol has been studied by X-ray powder diffraction, differential scanning calorimetry (DSC), Raman scattering and IR spectroscopy.
1-Eicosanol has been used:in gradient HPLC-charged aerosol detection method for the detection of different lipids;as internal standard during determination of policosanol's high molecular weight alcohols (policosanol's fatty alcohols) in fish oil by GC.

Specifications

Synonyms

EICOSANOL | N-1-Eicosanol | EC 211-119-4 | Icosan-1-ol | SCHEMBL108302 | 1-Eicosanol, purum, >=97.0% (GC) | E0004 | H10676 | Pri-N-eicosyl alcohol | 1QR1QRA9BU | Arachidyl alcohol, United States Pharmacopeia (USP) Reference Standard | eicosan-1-ol | HSDB

Specifications & Purity

≥95%(GC)

Storage

Room temperature

Shipped In

Normal

Action Type

INHIBITOR

Purity

≥95%(GC)

Names and Identifiers

• Pubchem Sid: 488181659
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181659
• Canonical Smiles: CCCCCCCCCCCCCCCCCCCCO
• IUPAC Name: icosan-1-ol
• InChIKey: BTFJIXJJCSYFAL-UHFFFAOYSA-N
• INCHI: 1S/C20H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h21H,2-20H2,1H3
• Isomeric SMILES: CCCCCCCCCCCCCCCCCCCCO
• Molecular Weight: 298.56
• Beilstein: 1431
• Reaxy-Rn: 1705104
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1705104&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Long-chain fatty alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long chain fatty alcohol - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as long-chain fatty alcohols. These are fatty alcohols that have an aliphatic tail of 13 to 21 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

Associated Targets(non-human)

Staphylococcus aureus (210822 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Solubility water: slightly soluble 0.001 g/L at 23 °C; Solubility in hot Methanol very faint turbidity
• Flash Point(°F): 383°F
• Flash Point(°C): 195°C
• Boil Point(°C): 190°C/1.3mmHg
• Melt Point(°C): 64-66℃
• Molecular Weight: 298.500 g/mol
• XLogP3: 9.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 18
• Exact Mass: 298.324 Da
• Monoisotopic Mass: 298.324 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 167.000
• 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

References

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