Grundinformationen
- CAS
557-61-9- Standard-SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCO- InChIKey
CNNRPFQICPFDPO-UHFFFAOYSA-N- Summenformel
- C28H58O
- Durchschnittliche Molmasse
- 410,8 g/mol
- Monoisotopische Masse
- 410,44876647
Überblick
1-octacosanol is a white crystalline powder. (NTP, 1992)
Namen und Bezeichner
- Bevorzugter Name
- 1-Octacosanol
- IUPAC
- octacosan-1-ol
- Lokaler Name
- Octacosan-1-ol
- Englischer Name
- 1-Octacosanol
- Summenformel
- C28H58O
- Molmasse
- 410.76
Namen und Synonyme
1-OctacosanolOctacosanolOctacosan-1-ol557-61-9Montanyl alcoholCluytyl alcoholOctacosyl alcoholn-OctacosanolOctanosoloctacosyl81I2215OVKNSC-10770
Weitere Namen anzeigen
PolicosanolNSC 10770NSC 57768Octacosanoctacosanol
DTXSID1025803CHEBI:28243NSC10770RefChem:25872DTXCID305803DTXSID901019021209-181-2OCTACOSANOL-1
Datenbank-Bezeichner
- CAS
557-61-9- PubChem CID
- 68406
- DTXSID
DTXSID1025803- ChEMBL
CHEMBL1951714- ChEBI
CHEBI:28243- UNII
- 81I2215OVK
- EC Number
- 209-181-2
- Nikkaji
- J10.708E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 13,8
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 26
- Schwere Atome
- 29
- Formalladung
- 0
- Komplexität
- 263
Experimentelle und physikochemische Eigenschaften
Drugs
Pharmaceuticals -> Antilipidemics
Pharmaceuticals -> Listed in ZINC15
LipidsFatty Acyls [FA] -> Fatty alcohols [FA05]
PolymersOther Classes -> Alcohols and Polyols, Other
Solubilityless than 1 mg/mL at 70.7 °F (NTP, 1992)
Boiling Point392 to 482 °F at 1 mmHg (sublimes) (NTP, 1992)
Melting Point
181.9 °F (NTP, 1992)
83.2 - 83.4 °C
Physical Description
1-octacosanol is a white crystalline powder. (NTP, 1992)
White solid; [CAMEO] White powder; [Aldrich MSDS]
Solid
Physikochemische Eigenschaften
- Schmelzpunkt
- 81 · 81-83°C
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 80% (4 of 5) of all reports.
Warning
H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: 1-Octacosanol
1-Octacosanol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - 1-Octacosanol: Human health tier I assessment
Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: This chemical may cause irritation.
Hazards Summary
Aliphatic alcohols are metabolized and eliminated efficiently; Not skin sensitizers; May have low-grade liver effects; CNS depression seen in shorter chain alcohols, e.g., 1-hexanol and 1-octanol; [Reference #1] May cause irritation; [Aldrich MSDS]
Reactive GroupAlcohols and Polyols
Reactivity Profile
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsExtracellular
Verwendung und Herstellung
UsesFound in vegetable waxes; [Merck Index]
General Manufacturing Information1-Octacosanol: ACTIVE
Anwendungen
OccurrenceOctacosanol is developed from wheat germ, sugar cane, or vegetable waxes.
VerwendenA 28-carbon primary fatty alcohol commonly found in the epicuticular waxes of plants. It has shown protective effects against parkonsonism and due to its excellent tolerability and non-toxicity, octacosanol may be a promising agent for PD treatment.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
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