{(2E,6E)-2,6-Bis[(2Z)-2-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)ethylidene]cyclohexylidene}malononitrile
[CAS# 69415-28-7]

Identification

• Name: {(2E,6E)-2,6-Bis[(2Z)-2-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)ethylidene]cyclohexylidene}malononitrile
• Synonyms: 2-(2,6-bis{(E)-2-[3-ethyl-1,3-benzothiazol-2(3H)-ylidene]ethylidene}cyclohexylidene)malononitrile; Propanedinitrile, [2,6-bis[(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]cyclohexylidene]- (9CI)
• Molecular Formula: C₃₁H₂₈N₄S₂
• Molecular Weight: 520.71
• CAS Registry Number: 69415-28-7
• SMILES: CCN1c2ccccc2SC1=CC=C3CCCC(=CC=C4N(c5ccccc5S4)CC)C3=C(C#N)C#N
• InChI: 1S/C31H28N4S2/c1-3-34-25-12-5-7-14-27(25)36-29(34)18-16-22-10-9-11-23(31(22)24(20-32)21-33)17-19-30-35(4-2)26-13-6-8-15-28(26)37-30/h5-8,12-19H,3-4,9-11H2,1-2H3/b22-16+,23-17+,29-18-,30-19-
• InChIKey: AUNNOOXNARRSIW-INDCHUMNSA-N

Properties

• Density: 1.392g/cm³ (Cal.)
• Boiling point: 593.867°C at 760 mmHg (Cal.)
• Flash point: 312.959°C (Cal.)