(2E,6E)-2,6-Bis[(2Z)-2-(3-Ethyl-1,3-Benzothiazol-2(3H)-Ylidene)Ethylidene]Cyclohexanone
[CAS# 53115-00-7]

Identification

• Name: (2E,6E)-2,6-Bis[(2Z)-2-(3-Ethyl-1,3-Benzothiazol-2(3H)-Ylidene)Ethylidene]Cyclohexanone
• Synonyms: 2,6-bis{(E)-2-[3-ethyl-1,3-benzothiazol-2(3H)-ylidene]ethylidene}cyclohexanone; Cyclohexanone, 2,6-bis[(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]- (9CI)
• Molecular Formula: C₂₈H₂₈N₂OS₂
• Molecular Weight: 472.66
• CAS Registry Number: 53115-00-7
• SMILES: CCN1c2ccccc2SC1=CC=C3CCCC(=CC=C4N(c5ccccc5S4)CC)C3=O
• InChI: 1S/C28H28N2OS2/c1-3-29-22-12-5-7-14-24(22)32-26(29)18-16-20-10-9-11-21(28(20)31)17-19-27-30(4-2)23-13-6-8-15-25(23)33-27/h5-8,12-19H,3-4,9-11H2,1-2H3/b20-16+,21-17+,26-18-,27-19-
• InChIKey: JIPAOFKZFLJOPW-OCCIKNCCSA-N

Properties

• Density: 1.382g/cm³ (Cal.)
• Boiling point: 610.66°C at 760 mmHg (Cal.)
• Flash point: 323.115°C (Cal.)