1,10-Decanediol
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Grundinformationen
- CAS
112-47-0- Standard-SMILES
OCCCCCCCCCCO- InChIKey
FOTKYAAJKYLFFN-UHFFFAOYSA-N- Summenformel
- C10H22O2
- Durchschnittliche Molmasse
- 174,28 g/mol
- Monoisotopische Masse
- 174,16197994
Überblick
1,10-decanediol has been reported in Perilla frutescens with data available.
Namen und Bezeichner
- Bevorzugter Name
- 1,10-Decanediol
- IUPAC
- decane-1,10-diol
- Englischer Name
- 1,10-Decanediol
- Summenformel
- C10H22O2
- Molmasse
- 174.28
Namen und Synonyme
1,10-Decanediol112-47-0Decamethylene glycolDecamethylenediol1,10-Dihydroxydecane1,10-Decamethylenediolalpha,omega-Decanediol5I577UDK52NSC-17165SPEZIOL C 10/2DTXSID3059420RefChem:71143
Weitere Namen anzeigen
DecanediolNSC406706NSC 406706NSC-406706Cetanediol10-Decanediol1,10-Decadiol1,10-Decandiol1, 10 - decane
DTXCID4033261203-975-2Decane-1,10-diol1,10-Decamethylene diol1,6-Bis(2-hydroxyethyl)hexane.alpha.,.omega.-DecanediolNSC 17165MFCD00004749
Datenbank-Bezeichner
- CAS
112-47-0- PubChem CID
- 37153
- DTXSID
DTXSID3059420- UNII
- 5I577UDK52
- EC Number
- 203-975-2
- Nikkaji
- J10.105B
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 40,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 9
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 64,2
Experimentelle und physikochemische Eigenschaften
PolymersOther Classes -> Alcohols and Polyols, Other
CosmeticsCosmetic ingredients (1,10-Decanediol) -> CIR (Cosmetic Ingredient Review)
SpringerMaterials PropertiesDensity
Physical Description
Liquid
Solid; [Merck Index] White solid; [Sigma-Aldrich MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 70 · 70-73 °C
- Siedepunkt
- 297 °C · 297 °C
- Dichte
- 1 · 1,08 g/cm3
- Dampfdruck
- 0.1 hPa · <0.1 hPa (20 °C)
- Brechungsindex
- 1.4603 · 1.4603 (estimate)
- Flammpunkt
- 152 °C · 152 °C
- storage temp.
- 30 °C · Store below +30°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 99.3% (148 of 149) of all reports.
Not Classified
Aggregated GHS information provided per 149 reports by companies from 2 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 1,10-Decanediol
1,10-Decanediol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,10-Decanediol are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 20-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19334
1,10-Decanediol: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazards SummaryIntraperitoneal lethal-dose (mouse) > 500 mg/kg; [RTECS] May cause irritation; [Sigma-Aldrich MSDS] See 1-Decanol.
Hazard Classes and CategoriesNot Classified
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
Chemie und Industrie
Verwendung und Herstellung
Uses
CIR ingredient: 1,10-Decanediol
Used as an intermediate in organic synthesis; [ExPub: EPA - TSCATS]
U.S. Production2023: <50,000 lb
Industry UsesIntermediate
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
1,10-Decanediol: ACTIVE
Anwendungen
Verwenden1,10-Decanediol is an minor intermediate in the production of polyesters. It also used in essence, perfumes and in pharmaceuticals. The diacrylate is hydrophobic and used for flexible dental materials, radiation curable coatings, and for lenses.
Darstellung
synthetische1,10-Decanediol is produced from sebacic acid by a hydrogenation process analogous to that described for 1,6-hexanediol.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
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