Sodium ethanethiolate

HCID 4459711CAS 811-51-8

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Grundinformationen

Standard-SMILES: CC[S-].[Na+]
InChIKey: QJDUDPQVDAASMV-UHFFFAOYSA-M
Summenformel: C2H5NaS
Durchschnittliche Molmasse: 84,12 g/mol
Monoisotopische Masse: 84,00096544

Namen und Bezeichner

Bevorzugter Name: Sodium ethanethiolate
IUPAC: sodium ethanethiolate
Englischer Name: SODIUM ETHANETHIOLATE
Summenformel: C2H6S.Na
Molmasse: 85.12

Namen und Synonyme

Sodium ethanethiolate811-51-8Ethanethiol sodium saltDTXSID001001774RefChem:887524DTXCID301428715684-910-9sodium;ethanethiolateEthanethiol, sodium saltC2H5NaSMFCD00066318Ethyl mercaptan sodium salt

Weitere Namen anzeigen

Sodium ethylthiolateEhylmercaptansodiumsaltSodium ethyl mercaptanateSODIUM ETHANETHIOLATE, TECH., 80%ethylthiolsodiumSodium EthanethioLSodium ethyl sulfide

sodiumethanethiolateNaSEtsodium thioethoxidesodium ethanthiolatesodium ethylsulfanideSodium ethyl mercaptideSCHEMBL129023Sodium ethanethiolate, technical

Datenbank-Bezeichner

CAS: 811-51-8
PubChem CID: 4459711
DTXSID: DTXSID001001774
EC Number: 684-910-9
Nikkaji: J7.105F

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 4
Formalladung: 0
Komplexität: 6

Experimentelle und physikochemische Eigenschaften

Chemical ClassesMetals -> Organic Compounds, Metal Salts

Physical DescriptionBeige crystals with a stench; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

storage temp.: Inert atmosphere,Room Temperature
Löslichkeit: Methanol (Slightly), Water (Sparingly, Heated)
Aggregatzustand: Solid
Farbe: White to Off-White
BRN: 3593647 · 3593647
InChI: InChI=1S/C2H6S.Na.H/c1-2-3;;/h3H,2H2,1H3;;
InChIKey: QJDUDPQVDAASMV-UHFFFAOYSA-M
SMILES: C(S)C.[NaH]

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 68 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazards SummaryReacts violently with water; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Sigma-Aldrich MSDS] See Sodium methanethiolate.

Hazard Classes and CategoriesSkin Corr. 1B (100%)