[(2Z)-2-(3-Ethyl-1,3-Benzothiazol-2(3H)-Ylidene)Ethylidene]Malononitrile
[CAS# 57296-02-3]

Identification

• Name: [(2Z)-2-(3-Ethyl-1,3-Benzothiazol-2(3H)-Ylidene)Ethylidene]Malononitrile
• Synonyms: [(2Z)-2-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)ethylidene]malononitrile; Propanedinitrile, [(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]- (9CI); ; Malononitrile, [2-(3-ethyl-2-benzothiazolinylidene)ethylidene]- (6CI, 7CI); ; NK 3054
• Molecular Formula: C₁₄H₁₁N₃S
• Molecular Weight: 253.32
• CAS Registry Number: 57296-02-3
• SMILES: N#C/C(C#N)=C\C=C2/Sc1ccccc1N2CC
• InChI: 1S/C14H11N3S/c1-2-17-12-5-3-4-6-13(12)18-14(17)8-7-11(9-15)10-16/h3-8H,2H2,1H3/b14-8-
• InChIKey: WBHQBVPTJRAPIJ-ZSOIEALJSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 352.942°C at 760 mmHg (Cal.)
• Flash point: 167.254°C (Cal.)