13520

S-Benzylisothioharnstoff -hydrochlorid

purum, ≥98.0% (AT)

• Synonym(e): S-Benzylthiuroniumchlorid
• Lineare Formel: NH₂C(SCH₂C₆H₅)=NH · HCl
• CAS-Nummer: 538-28-3
• Molekulargewicht: 202.70
• EC Number: 208-688-6
• UNSPSC Code: 12352100
• PubChem Substance ID: 329750206
• Beilstein/REAXYS Number: 3656719
• MDL number: MFCD00012583
• eCl@ss: 32150313
• Assay: ≥98.0% (AT)
• Form: solid

Eigenschaften

• grade: purum
• assay: ≥98.0% (AT)
• form: solid
• mp: 172-177 °C
• solubility: ethanol: soluble 1 g/10 mL, clear, colorless to faintly greenish-yellow
• functional group: amine, phenyl, thioether
• SMILES string: Cl.NC(=N)SCc1ccccc1
• InChI: 1S/C8H10N2S.ClH/c9-8(10)11-6-7-4-2-1-3-5-7;/h1-5H,6H2,(H3,9,10);1H
• InChI key: WJAASTDRAAMYNK-UHFFFAOYSA-N

Beschreibung

General description

S-Benzylisothiourea reacts with ethyl-γ-bromoacetoacetate to yield 2-benzylthio-4-benzylthio-methyl-6-hydroxypyrimidine.

Application

S-Benzylisothiourea hydrochloride was used to study the preparation, physical properties and supramolecular crystal structure of the ionic compound bis-(S-Benzylthiuronium)chloranilate.

Sicherheitshinweise

• Piktogramme: GHS06
• Signalwort: Danger
• Gefahrencodes: H300
• Sicherheitshinweise: P264 - P301 + P310
• Hazard Classifications: Acute Tox. 2 Oral
• Lagerklasse: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• WGK: WGK 3
• Flammpunkt (°F): Not applicable
• Flammpunkt (°C): Not applicable
• PSA (Persönliche Schutzausrüstung): Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges