(2E)-2,3-Bis(2,4,5-Trimethyl-3-Thienyl)-2-Butenedinitrile
[CAS# 112440-50-3]

Identification

• Name: (2E)-2,3-Bis(2,4,5-Trimethyl-3-Thienyl)-2-Butenedinitrile
• Synonyms: trans-1,2-Dicyano-1,2-bis(2,4,5-trimethyl-3-thienyl)ethene
• Molecular Formula: C₁₈H₁₈N₂S₂
• Molecular Weight: 326.48
• CAS Registry Number: 112440-50-3
• SMILES: Cc2c(C(/C#N)=C(\C#N)c1c(C)c(C)sc1C)c(C)sc2C
• InChI: 1S/C18H18N2S2/c1-9-11(3)21-13(5)17(9)15(7-19)16(8-20)18-10(2)12(4)22-14(18)6/h1-6H3/b16-15+
• InChIKey: AYNDKKQQUZPETC-FOCLMDBBSA-N

Properties

• Density: 1.184g/cm³ (Cal.)
• Melting point: 167°C (Expl.)
• Boiling point: 441.512°C at 760 mmHg (Cal.)
• Flash point: 220.819°C (Cal.)
• Refractive index: 1.611 (Cal.)