Sodium benzenethiolate
Grundinformationen
- CAS
930-69-8- Standard-SMILES
[Na+].[S-]c1ccccc1- InChIKey
RZWQDAUIUBVCDD-UHFFFAOYSA-M- Summenformel
- C6H5NaS
- Durchschnittliche Molmasse
- 132,16 g/mol
- Monoisotopische Masse
- 132,00096561
Namen und Bezeichner
- Bevorzugter Name
- Sodium benzenethiolate
- IUPAC
- sodium benzenethiolate
Namen und Synonyme
SODIUM BENZENETHIOLATE930-69-8Sodium thiophenoxideSodium phenylthiolateBenzenethiol, sodium saltSodium thiophenylateSodium phenylsulfideSodium phenylmercaptideThiophenyl sodium saltDTXSID1027342UNII-75GF5O2O8Y75GF5O2O8Y
Weitere Namen anzeigen
HSDB 5771Benzenethiol, sodium salt (1:1)EINECS 213-224-0DTXCID307342SODIUM BENZENETHIOLATE [HSDB]RefChem:183794213-224-0SODIUM THIOPHENATE
Datenbank-Bezeichner
- CAS
930-69-8- PubChem CID
- 4110039
- DTXSID
DTXSID1027342- ChEMBL
CHEMBL3182565- UNII
- 75GF5O2O8Y
- EC Number
- 213-224-0
- Nikkaji
- J28.470J
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 50
Experimentelle und physikochemische Eigenschaften
Physical DescriptionFaintly beige solid with a stench; [MSDSonline]
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory.；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
Hazards SummaryA corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis and pulmonary edema; [Aldrich MSDS] See Benzenethiol.
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Toxikologische Informationen
Adverse EffectsOther Poison - Chemical Asphyxiant；Dermatotoxin - Skin burns.；Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.
Chemie und Industrie
Verwendung und Herstellung
Uses
Used as antioxidant, corrosion inhibitor, laboratory demethylating agent, and to make retinol substitution analogs and phosphorodithioate fungicides; [HSDB]
Antioxidant and corrosion inhibitor
Used as a demethylating agent in the laboratory in which bisquaternary ammonium compound extracted from tissue homogenates or body fluids into dichloromethane as an ion pair with hexanitrodiphenylamine (DPA). The evaporated ion pair residue is demethylated with sodium benzenethiolate to form the corresponding tertiary amine.
Used in the synthesis of retinol substitution analogs.
Used in synthesis of phosphorodithioate fungicides.
General Manufacturing InformationBenzenethiol, sodium salt (1:1): ACTIVE
Zugehörige Reaktionen
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