476013

Isopropylisothiocyanat

97%

• Synonym(e): Isopropylsenföl
• Lineare Formel: (CH₃)₂CHNCS
• CAS-Nummer: 2253-73-8
• Molekulargewicht: 101.17
• EG-Nummer: 218-851-3
• MDL-Nummer: MFCD00037830
• UNSPSC-Code: 12352100
• PubChem Substanz-ID: 24871201
• NACRES: NA.22

Eigenschaften

• Qualitätsniveau: 200
• Assay: 97%
• Brechungsindex: n20/D 1.493 (lit.)
• bp: 29-30 °C/10 mmHg (lit.)
• Dichte: 0.948 g/mL at 25 °C (lit.)
• Funktionelle Gruppe: amine; isothiocyanate
• SMILES String: CC(C)N=C=S
• InChI: 1S/C4H7NS/c1-4(2)5-3-6/h4H,1-2H3
• InChIKey: VHBFEIBMZHEWSX-UHFFFAOYSA-N

Beschreibung

Allgemeine Beschreibung

Isopropyl isothiocyanate is an isothiocyanate derivative. It has been identified as one of the volatile components in the following:

• seed kernel and leaf of Moringa peregrina (Forssk.) Fiori, Agricolt1
• essential oil isolated from Upland Wasabi
• hydrodistillates of hedge mustard (Sysimbrium officinale)

Molecular conformations of isopropyl isothiocyanate in gas phase have been determined by electron diffraction studies. It has been synthesized by employing isopropyl amine as a starting reagent.

Anwendung

Isopropyl isothiocyanate may be used to synthesize 4-bromo-5,6-dichloro-2-isopropylaminobenzimidazole.

Sicherheitshinweise

• Piktogramme: GHS02,GHS07
• Signalwort: Warning
• H-Sätze: H226,H315,H319,H335
• P-Sätze: P210 - P302 + P352 - P305 + P351 + P338
• Gefahreneinstufungen: Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
• Zielorgane: Respiratory system
• Lagerklassenschlüssel: 3 - Flammable liquids
• WGK: WGK 3
• Flammpunkt (°F): 104.0 °F - closed cup
• Flammpunkt (°C): 40 °C - closed cup
• Persönliche Schutzausrüstung: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter