Grundinformationen
- Standard-SMILES
CC(C)OC(=O)CCCCCCCCC(=O)OC(C)C- InChIKey
XFKBBSZEQRFVSL-UHFFFAOYSA-N- Summenformel
- C16H30O4
- Durchschnittliche Molmasse
- 286,41 g/mol
- Monoisotopische Masse
- 286,21440943
Namen und Bezeichner
- Bevorzugter Name
- Diisopropyl Sebacate
- IUPAC
- dipropan-2-yl decanedioate
- Lokaler Name
- Diisopropylsebacat
- Englischer Name
- Diisopropyl sebacate
- Summenformel
- C16H30O4
- Molmasse
- 286.41
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
7491-02-3- PubChem CID
- 24096
- DTXSID
DTXSID3064720- UNII
- J8T3X564IH
- EC Number
- 231-306-4
- Nikkaji
- J26.295A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,4
- Polarare Oberfläche (TPSA)
- 52,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 13
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 244
Physikochemische Eigenschaften
- Siedepunkt
- 308.2 · 308.2±10.0 °C(Predicted)
- Dichte
- 0.953 · 0.953±0.06 g/cm3(Predicted)
- Dampfdruck
- 0.005 Pa · 0.005Pa at 20℃
- storage temp.
- Refrigerator
- Löslichkeit
- Chloroform (Slightly), Ethyl Acetate (Very Slightly)
- Aggregatzustand
- Oil
- Farbe
- Clear Colourless
- Wichte
- 0.94 · 0.94
- Wasserlöslichkeit
- 2 mg/L · 2mg/L at 20℃
- Kosmetik-Inhaltsstoffe Funktionen
- SOLVENTSKIN CONDITIONINGSKIN CONDITIONING - EMOLLIENTPLASTICISER
- LogP
- 4.627 · 4.627 (est)
- CAS Datenbank
- 7491 · 7491-02-3(CAS DataBase Reference)
- EPA chemische Informationen
- Decanedioic acid, bis(1-methylethyl) ester (7491-02-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (97 of 97) of all reports.
Not Classified;Reported as not meeting GHS hazard criteria by 97 of 97 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 97 reports by companies from 1 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 97 of 97 reports by companies.;There are 0 notifications provided by 0 of 97 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information
Chemical: Decanedioic acid, bis(1-methylethyl) ester
Status: Active Update: 06-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10094
Decanedioic acid, bis(1-methylethyl) ester: Does not have an individual approval but may be used under an appropriate group standard
Toxikologische Informationen
Regulatorische Informationen
Regulatory Information
Chemical: Decanedioic acid, bis(1-methylethyl) ester
Status: Active Update: 06-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10094
Decanedioic acid, bis(1-methylethyl) ester: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
Use Classification
EPA Safer Chemical Functional Use Classes -> Solvents
Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern
Cosmetics -> Emollient
Anwendungen
Verwendendiisopropyl sebacate can be used in cosmetic formulations for its emollient properties. It is also used as a solvent, particularly for fragrances.
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