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Polyoxyethylene sorbitan monostearate

HCID 22833389
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Grundinformationen

CAS
9005-67-8
Standard-SMILES
CCCCCCCCCCCC(=O)OC[C@@H](O)[C@H]1OC[C@H](OCCO)[C@H]1OCCO
InChIKey
CRBBOOXGHMTWOC-NPDDRXJXSA-N
Summenformel
C22H42O8
Durchschnittliche Molmasse
434,6 g/mol
Monoisotopische Masse
434,28796829

Überblick

1,4-Anhydro-6-O-dodecanoyl-2,3-bis-O-(2-hydroxyethyl)-D-glucitol is a fatty acid ester.

Namen und Bezeichner

Bevorzugter Name
Polyoxyethylene sorbitan monostearate
IUPAC
[(2R)-2-[(2R,3R,4S)-3,4-bis(2-hydroxyethoxy)oxolan-2-yl]-2-hydroxyethyl] dodecanoate
Englischer Name
Tween 60
Summenformel
C64H126O26
Molmasse
0

Namen und Synonyme

(2R)-2-[(2R,3R,4S)-3,4-bis(2-hydroxyethoxy)oxolan-2-yl]-2-hydroxyethyl dodecanoateDTXSID9029300Polysorbata 60(2R)-2-((2R,3R,4S)-3,4-bis(2-hydroxyethoxy)oxolan-2-yl)-2-hydroxyethyl dodecanoateRefChem:1096504PEG-20 sorbitan palmitostearateINS-435E-435Polyoxyethylene 20 sorbitan monopalmitostearatePolyoxyethylene(20)sorbitan monopalmitostearate618-984-0CAL22UVI4M
Weitere Namen anzeigen
POLYSORBATE 60POLYOXYETHYLENE (20) SORBITAN MONOSTEARATETween 60, CPPolysorbat 60POLYOXYETHYLENE SORBITAN MONOSTEARATET-61PolysoFEMA 2916TWEEN(R) 60POLYETHYLENE GLYCOL SORBITAN MONOSTEARATE
CHEBI:53425FEMA No. 2916PEG sorbitan stearateSorbimacrogol stearate 300[(2R)-2-[(2R,3R,4S)-3,4-bis(2-hydroxyethoxy)oxolan-2-yl]-2-hydroxyethyl] dodecanoateSorbomacrogol stearate 300Tween? 60DSSTox_CID_9300

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,8
Polarare Oberfläche (TPSA)
115 Ų
H-Brücken-Donoren
3
H-Brücken-Akzeptoren
8
Frei drehbare Bindungen
20
Schwere Atome
30
Formalladung
0
Komplexität
420

Experimentelle und physikochemische Eigenschaften

PolymersOther Classes -> Polyoxyethylenes
CosmeticsCosmetic ingredients (Polysorbate 60) -> CIR (Cosmetic Ingredient Review)
FragrancesFragrance Ingredient (Polysorbate 60) -> IFRA transparency List
Food AdditivesBOILER WATER ADDITIVE, EMULSIFIER OR EMULSIFIER SALT, FLAVORING AGENT OR ADJUVANT, STABILIZER OR THICKENER, SURFACE-ACTIVE AGENT -> FDA Substance added to food
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description · 2 Einträge

Dark yellow opaque viscous liquid; [Sigma-Aldrich MSDS]

Liquid

Physikochemische Eigenschaften

Schmelzpunkt
23 °C · 23 °C
Siedepunkt
802.68 °C · 802.68°C (rough estimate)
Dichte
1.1 g/cm · 1.1 g/cm 3 at 20 °C

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Sorbitan, monooctadecanoate, poly(oxy-1,2-ethanediyl) derivs.

FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used.

Sorbitan, monooctadecanoate, poly(oxy-1,2-ethanediyl) derivs.: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 Eintrag

No evidence of reproductive or developmental toxicity in rats; [ToxPlanet: Shepard's Catalog of Teratogenic Agents] Causes pigmented or nucleated red blood cells and changes in erythrocyte count in 95-week constant oral studies of mice; Oral LD50 (rat) > 60 mL/kg; [RTECS] Acceptable daily intake (ADI) of 0-25 mg/kg; [JECFA] Not considered hazardous by GHS classification; [Sigma-Aldrich MSDS]

EPA Safer ChemicalChemical: Sorbitan, monooctadecanoate, poly(oxy-1,2-ethanediyl) derivs.

Toxikologische Informationen

Toxicity Summary · 2 Einträge

The CIR Expert Panel concluded that the polysorbates listed below are safe in cosmetics when formulated to be nonirritating. This conclusion supersedes the conclusion reached in the 1984, 2000, and 2001 CIR safety assessments...Polysorbate 60...

Safe for use in cosmetics, with qualifications

Sicherheitsdaten

wgk
1
tsca
TSCA listed
hs_code
34021300
RTECS-Nr.
WG2934000
Toxizität

Chemie und Industrie

Pharmakologische Informationen

Cellular LocationsMembrane

Verwendung und Herstellung

Uses · 3 Einträge

CIR ingredient: Polysorbate 60

Used as a flavoring agent, emulsifier, boiler water additive, surface-active agent, and stabilizer or thickener for foods; [FDA] Used in cosmetics, pharmaceuticals, as a lubricant and finish emulsifier for textile and leather manufacture, laboratory reagent, and flavoring; [ECHA REACH Registrations] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]

Leather Tanning and Processing [Category: Industry]

Use Classification · 5 Einträge

EPA Safer Chemical Functional Use Classes -> Surfactants

Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern

Fragrance Ingredients

Food Additives -> EMULSIFIER -> JECFA Functional Classes

Food Additives -> EMULSIFIER -> JECFA Functional Classes

General Manufacturing InformationSorbitan, monooctadecanoate, poly(oxy-1,2-ethanediyl) derivs.: ACTIVE
Anwendungen · 1 Eintrag

VerwendenTween 60 is an emulsifier manufactured by reacting stearic acid with sorbitol to yield a product which is reacted with ethylene oxide. It is a nonionic, waterdispersible surface-active agent which is very hydrophilic. It is also termed polysorbate 60. It is used in whipped vegetable toppings for overrun and lightness; in cakes for increased volume and fine grain; in icings and confectionery for lightness and syneresis control; and in salad dressing for emulsion stability. It is frequently used with sorbitan monostearate or monoand diglycerides. The typical usage range is 0.10–0.40%.

Vor- und nachgelagerte Produkte

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Datenbank-Bezeichner

CAS
9005-67-8、93906-96-8
PubChem CID
22833389
ChEMBL
CHEMBL3184465
ChEBI
CHEBI:177394
EC Number
618-984-0
Dampfdruck
10 hPa · <10 hPa (20 °C)
FEMA
2916 · 2916 | POLYSORBATE 60
Brechungsindex
20 · n 20/D 1.474
Flammpunkt
Not applicable
storage temp.
30 °C · Store below +30°C.
Löslichkeit
100 g/L · 100 g/L
pka
0 · 0[at 20 ℃]
Aggregatzustand
powder to lump to clear liquid
Farbe
White or Colorless to Yellow
Geruch (Odor)
mild alcoholic
PH
5.5 · 5.5-7.7 (50g/l, H2O, 25℃)
Geruchsart
alcoholic
Wasserlöslichkeit
100 g/L · 100 g/L
Merck
14 · 14,7582
Kosmetik-Inhaltsstoffe Funktionen
SURFACTANT - CLEANSINGSURFACTANT - EMULSIFYING
InChI
1S/C26H50O10/c1-2-3-4-5-6-7-8-9-10-11-24(30)34-19-18-31-20-22(32-15-12-27)26-25(35-17-14-29)23(21-36-26)33-16-13-28/h22-23,25-29H,2-21H2,1H3
InChIKey
HMFKFHLTUCJZJO-UHFFFAOYSA-N
SMILES
O1C(C(C(C1)OCCO)OCCO)C(OCCO)COCCOC(=O)CCCCCCCCCCC
LogP
3.938 at · 3.938 at 25℃
EPA chemische Informationen
60 · Polysorbate 60 (9005-67-8)
LD50 orally in Rabbit: > 38000 mg/kg
safety_code
24/25
Speicherklasse
10 - Combustible liquids

Vorgelagerte Rohstoffe

EpoxyStickstoffEthylenoxidSorbitanstearatWasserstoffperoxidStearinsureNatriumethanolatD-Glucitol

Nachgelagerte Produkte

Spining lubricant agent

Anbieter100 Anbieter

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Ergänzende Hinweise

DefinitionChEBI: A polymer composed of PEG-ylated sorbitan, where the total number of poly(ethylene glycol) units is 20 (w + x + y + z = 20) and a single terminal is capped by a stearate group.