2-Benzoyl-3,3-Bis(Methylsulfanyl)Acrylonitrile
[CAS# 29866-39-5]

Identification

• Name: 2-Benzoyl-3,3-Bis(Methylsulfanyl)Acrylonitrile
• Synonyms: ZINC00166054
• Molecular Formula: C₁₂H₁₁NOS₂
• Molecular Weight: 249.35
• CAS Registry Number: 29866-39-5
• SMILES: CSC(=C(C#N)C(=O)C1=CC=CC=C1)SC
• InChI: 1S/C12H11NOS2/c1-15-12(16-2)10(8-13)11(14)9-6-4-3-5-7-9/h3-7H,1-2H3
• InChIKey: WPJMZDZXZRCHOP-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 355.6±42.0°C at 760 mmHg (Cal.)
• Flash point: 168.8±27.9°C (Cal.)
• Refractive index: 1.616 (Cal.)