Oxybispropandiol

Diglycerin

HCID 42953CAS 59113-36-9

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Grundinformationen

Standard-SMILES: OCC(O)COCC(O)CO
InChIKey: GPLRAVKSCUXZTP-UHFFFAOYSA-N
Summenformel: C6H14O5
Durchschnittliche Molmasse: 166,17 g/mol
Monoisotopische Masse: 166,08412355

Überblick

Diglycerol is an alkylglycerol.

Namen und Bezeichner

Bevorzugter Name: Diglycerin
IUPAC: 3-(2,3-dihydroxypropoxy)propane-1,2-diol
Lokaler Name: Oxybispropandiol
Englischer Name: DIGLYCEROL
Summenformel: C6H14O5
Molmasse: 166.17

Namen und Synonyme

DiglycerolDiglycerin3-(2,3-dihydroxypropoxy)propane-1,2-diol3YC120743U3-glyceryloxypropane-1,2-diolGlycerol dimerRESASSOL DNDIGLYCERIN 801GREAT OIL DI 1RefChem:1083566Beautyturess 80gTanning CreamDTXSID10891325

Weitere Namen anzeigen

Polyglycerol-2POLYGLYCERYL-2K-COL-IIDiglycerin S

Beautyturess 80g Shiny Tanning Cream261-605-559113-36-9627-82-73,3'-Oxybis(propane-1,2-diol)alpha,alpha'-DiglycerolDiglycerine1,2-Propanediol, 3,3'-oxybis-

Datenbank-Bezeichner

CAS: 59113-36-9、627-82-7
PubChem CID: 42953
DTXSID: DTXSID90872273
ChEBI: CHEBI:140430
UNII: UC0A740LR3
EC Number: 211-013-8
Nikkaji: J6.871C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -2,5
Polarare Oberfläche (TPSA): 90,2 Å²
H-Brücken-Donoren: 4
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 6
Schwere Atome: 11
Formalladung: 0
Komplexität: 77

Experimentelle und physikochemische Eigenschaften

Cosmetics · 2 Einträge

Cosmetic ingredients (Diglycerin) -> CIR (Cosmetic Ingredient Review)

Solvent; Humectant

SpringerMaterials PropertiesViscosity

Physical DescriptionLiquid

Physikochemische Eigenschaften

Schmelzpunkt: 96 · 96-97 °C
Siedepunkt: 173 °C · 173 °C(Press: 14 Torr)
Dichte: 1.2774 g/cm3 · 1.2774 g/cm3
Dampfdruck: 0 Pa · 0Pa at 20℃
Wasserlöslichkeit: 1000 g/L · 1000g/L at 20℃
Kosmetik-Inhaltsstoffe Funktionen: HUMECTANTSKIN CONDITIONING
LogP: -2.5 at · -2.5 at 20℃
CAS Datenbank: 59113 · 59113-36-9
EPA chemische Informationen: Propanediol, oxybis- (59113-36-9)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 25.3% (23 of 91) of reports.

Warning

H315 (74.7%): 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 91 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Propanediol, oxybis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanediol, oxybis- 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

1,2-Propanediol, 3,3'-oxybis-: Does not have an individual approval but may be used under an appropriate group standard

EPA Safer ChemicalChemical: Diglycerin

Hazard Classes and CategoriesSkin Irrit. 2 (74.7%)

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