Batilol
Batyl Alcohol
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Grundinformationen
- CAS
544-62-7- Standard-SMILES
CCCCCCCCCCCCCCCCCCOCC(O)CO- InChIKey
OGBUMNBNEWYMNJ-UHFFFAOYSA-N- Summenformel
- C21H44O3
- Durchschnittliche Molmasse
- 344,6 g/mol
- Monoisotopische Masse
- 344,32904527
Überblick
Batilol is an alkylglycerol that is glycerol in which one of the primary hydroxy groups has been converted into the corresponding octadecyl ether. It is used in cosmetics as a stabilising ingredient and skin-conditioning agent.
Namen und Bezeichner
- Bevorzugter Name
- Batyl Alcohol
- IUPAC
- 3-octadecoxypropane-1,2-diol
- Lokaler Name
- Batilol
- Englischer Name
- Batyl alcohol
- Summenformel
- C21H44O3
- Molmasse
- 344.57
Namen und Synonyme
BATYL ALCOHOL544-62-7Batilol3-octadecoxypropane-1,2-diol1-O-OctadecylglycerolStearyl monoglyceride1,2-Propanediol, 3-(octadecyloxy)-BatilolumGlycerol monooctadecyl etherGlycerine 1-monostearyl etherMonooctadecyl ether of glycerolGlycerol octadecyl ether
Weitere Namen anzeigen
1-O-OCTADECYL-RAC-GLYCEROL3-OCTADECYLOXY-1,2-PROPANEDIOLICCB 70985Alkoxy glycerolDL-BATYL ALCOHOLC.1.Batylalcohol3-(Octadecyloxy)
NSC-284200CHEBI:3411739YR661C4URefChem:561112glyceryl 1-octadecyl ether3-octadecyloxy-propane-1,2-diol208-874-73-(octadecyloxy)propane-1,2-diol
Datenbank-Bezeichner
- CAS
544-62-7- PubChem CID
- 3681
- DTXSID
DTXSID0047799- ChEMBL
CHEMBL1482516
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 7,6
- Polarare Oberfläche (TPSA)
- 49,7 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 20
- Schwere Atome
- 24
- Formalladung
- 0
- Komplexität
- 221
Experimentelle und physikochemische Eigenschaften
Chemical ClassesOther Classes -> Other Organic Compounds
Cosmetics
Cosmetic ingredients (Batyl Alcohol) -> CIR (Cosmetic Ingredient Review)
Emollient
Physical DescriptionGlistening solid; [Merck Index] White powder; [MSDSonline]
Collision Cross Section202.8 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physikochemische Eigenschaften
- Schmelzpunkt
- 71 · 71-73 °C (lit.)
- Siedepunkt
- 419.64 °C · 419.64°C (rough estimate)
- Dichte
- 0.9975 · 0.9975 (rough estimate)
- Dampfdruck
- 0 Pa · 0Pa at 25℃
- Brechungsindex
- 1.5192 · 1.5192 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
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 33.3% (1 of 3) of reports.
Warning
H400 (66.7%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: 3-(Octadecyloxy) 1,2 propanediol
Status: Active Update: 18-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/27822
1,2-Propanediol, 3-(octadecyloxy)-: 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.
Hazards SummaryAn irritant; [MSDSonline]
Hazard Classes and CategoriesAquatic Acute 1 (66.7%)
Toxikologische Informationen
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
Uses
CIR ingredient: Batyl Alcohol
Recommended for bracken fern poisoning in cattle; [Merck Index]
Use ClassificationCosmetics -> Emollient
General Manufacturing Information1,2-Propanediol, 3-(octadecyloxy)-: INACTIVE
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Zugehörige Reaktionen
4
Notizen zur Verbindung
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