Grundinformationen
- Standard-SMILES
CCOC(=O)CS- InChIKey
PVBRSNZAOAJRKO-UHFFFAOYSA-N- Summenformel
- C4H8O2S
- Durchschnittliche Molmasse
- 120,17 g/mol
- Monoisotopische Masse
- 120,0245005
Überblick
Based on the available data, the CIR Expert Panel concluded that ... Ethyl Thioglycolate is safe for use in hair straighteners, permanent waves, tonics, dressings, and so forth, wave sets, other non-coloring hair products, and hair dyes and colors, as described in this safety assessment, at concentrations up to 15.2% (as Thioglycolic Acid). Hairdressers should avoid skin contact and minimize consumer skin exposure.
Namen und Bezeichner
- Bevorzugter Name
- Ethyl Thioglycolate
- IUPAC
- ethyl 2-sulfanylacetate
- Lokaler Name
- Ethylthioglykolat
- Englischer Name
- Ethyl Thioglycolate
- Summenformel
- C4H8O2S
- Molmasse
- 120.17
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
623-51-8- PubChem CID
- 12185
- DTXSID
DTXSID8049337- ChEMBL
CHEMBL3181965- UNII
- Z5SD8DD6CP
- EC Number
- 210-800-3
- Nikkaji
- J49.275B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,8
- Polarare Oberfläche (TPSA)
- 27,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 62,7
Experimentelle und physikochemische Eigenschaften
Cosmetics
Cosmetic ingredients (Ethyl Thioglycolate) -> CIR (Cosmetic Ingredient Review)
Hair waving or straightening; Reducing; Depilatory
Physikochemische Eigenschaften
- Schmelzpunkt
- -80 °C · -80 °C
- Siedepunkt
- 54 °C/12 · 54 °C/12 mmHg (lit.)
- Dichte
- 1.096 g/mL · 1.096 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.457(lit.)
- Flammpunkt
- 118 °F · 118 °F
- storage temp.
- 2 · Keep in dark place,Inert atmosphere,2-8°C
- Aggregatzustand
- Liquid
- pka
- 1 · pK1:7.95(SH) (25°C)
- Farbe
- Clear colorless
- Wasserlöslichkeit
- Not miscible or difficult to mix in water.
- BRN
- 605581 · 605581
- Stabilität
- Stable. Flammable. Incompatible with strong oxidizing agents, strong bases.
- Kosmetik-Inhaltsstoffe Funktionen
- REDUCINGDEPILATORYHAIR WAVING OR STRAIGHTENING
- InChI
- 1S/C4H8O2S/c1-2-6-4(5)3-7/h7H,2-3H2,1H3
- InChIKey
- PVBRSNZAOAJRKO-UHFFFAOYSA-N
- SMILES
- CCOC(=O)CS
- LogP
- 1.134 · 1.134 (est)
- CAS Datenbank
- 623 · 623-51-8(CAS DataBase Reference)
- EPA chemische Informationen
- Acetic acid, mercapto-, ethyl ester (623-51-8)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H226 (98.1%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P316, P302+P352, P303+P361+P353, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 53 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Status: Active Update: 03-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34481
Ethyl thioglycolate: Does not have an individual approval but may be used under an appropriate group standard
Toxikologische Informationen
Toxicity Summary
Based on the available data, the CIR Expert Panel concluded that ... Ethyl Thioglycolate is safe for use in hair straighteners, permanent waves, tonics, dressings, and so forth, wave sets, other non-coloring hair products, and hair dyes and colors, as described in this safety assessment, at concentrations up to 15.2% (as Thioglycolic Acid). Hairdressers should avoid skin contact and minimize consumer skin exposure.
Safe for use in cosmetics, with qualifications
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1992 3/PG 3
- hs_code
- 29309090
- RTECS-Nr.
- AI6650000
- risk_code
- 10-25-36/38
- hazard_code
- T
- safety_code
- 26-36/37/39-45
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenIt finds its application in the reaction of the dilithio-derivative with an aldehyde, followed by conversion to the episulfide by reaction with ethyl chloroformate, and desulfurization with triethyl phosphite, leads to the (E)-2-alkenoic acid with high stereoselectivity. It is used as depilatories, hair straightening agent, hair waving agent, and reducing agent in cosmetic industry.
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