Ethyl (2Z)-Cyano{3-[(Z)-(3-Ethyl-6-Methoxy-1,3-Benzothiazol-2(3H)-Ylidene)Methyl]-2-Cyclohexen-1-Ylidene}Acetate
[CAS# 56001-97-9]

Identification

• Name: Ethyl (2Z)-Cyano{3-[(Z)-(3-Ethyl-6-Methoxy-1,3-Benzothiazol-2(3H)-Ylidene)Methyl]-2-Cyclohexen-1-Ylidene}Acetate
• Synonyms: Acetic acid, cyano[3-[(3-ethyl-6-methoxy-2(3H)-benzothiazolylidene)methyl]-2-cyclohexen-1-ylidene]-, ethyl ester (9CI); ethyl (2Z)-cyano{3-[(Z)-(3-ethyl-6-methoxy-1,3-benzothiazol-2(3H)-ylidene)methyl]cyclohex-2-en-1-ylidene}acetate
• Molecular Formula: C₂₂H₂₄N₂O₃S
• Molecular Weight: 396.50
• CAS Registry Number: 56001-97-9
• SMILES: CCN1c2ccc(cc2SC1=CC3=CC(=C(C#N)C(=O)OCC)CCC3)OC
• InChI: 1S/C22H24N2O3S/c1-4-24-19-10-9-17(26-3)13-20(19)28-21(24)12-15-7-6-8-16(11-15)18(14-23)22(25)27-5-2/h9-13H,4-8H2,1-3H3/b18-16-,21-12-
• InChIKey: UNCNFZXPLQAZQS-HFHFKWKOSA-N

Properties

• Density: 1.265g/cm³ (Cal.)
• Boiling point: 534.902°C at 760 mmHg (Cal.)
• Flash point: 277.299°C (Cal.)