2-(2-Chlorobenzoyl)-3,3-Bis(Methylsulfanyl)Acrylonitrile
[CAS# 175137-51-6]

Identification

• Name: 2-(2-Chlorobenzoyl)-3,3-Bis(Methylsulfanyl)Acrylonitrile
• Synonyms: BENZENEPROPANENITRILE, A-[BIS(METHYLTHIO)METHYLENE]-2-CHLORO-B-OXO-; Maybridge3_003379; ZINC00166066
• Molecular Formula: C₁₂H₁₀ClNOS₂
• Molecular Weight: 283.80
• CAS Registry Number: 175137-51-6
• SMILES: O=C(c1ccccc1Cl)C(\C#N)=C(/SC)SC
• InChI: 1S/C12H10ClNOS2/c1-16-12(17-2)9(7-14)11(15)8-5-3-4-6-10(8)13/h3-6H,1-2H3
• InChIKey: RQYDKKSGAOHYPI-UHFFFAOYSA-N

Properties

• Density: 1.329g/cm³ (Cal.)
• Boiling point: 393.835°C at 760 mmHg (Cal.)
• Flash point: 191.985°C (Cal.)
• Refractive index: 1.624 (Cal.)