2-(1,3-Benzothiazol-2-Yl)-3-Methyl-2-Butenenitrile
[CAS# 392724-16-2]

Identification

• Name: 2-(1,3-Benzothiazol-2-Yl)-3-Methyl-2-Butenenitrile
• Synonyms: 2-(benzo[d]thiazol-2-yl)-3-methylbut-2-enenitrile; 2-benzothiazol-2-yl-3-methylbut-2-enenitrile; BAS 02626949
• Molecular Formula: C₁₂H₁₀N₂S
• Molecular Weight: 214.29
• CAS Registry Number: 392724-16-2
• SMILES: CC(=C(C#N)C1=NC2=CC=CC=C2S1)C
• InChI: 1S/C12H10N2S/c1-8(2)9(7-13)12-14-10-5-3-4-6-11(10)15-12/h3-6H,1-2H3
• InChIKey: LFRAFAQWIPZCRG-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 357.5±44.0°C at 760 mmHg (Cal.)
• Flash point: 170.0±28.4°C (Cal.)
• Refractive index: 1.645 (Cal.)