[(2E,4Z)-4-(3-Ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-buten-1-ylidene]malononitrile
[CAS# 92872-47-4]

Identification

• Name: [(2E,4Z)-4-(3-Ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-buten-1-ylidene]malononitrile
• Synonyms: [(2E,4Z)-4-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)but-2-enylidene]malononitrile; Malononitrile, [4-(3-ethyl-2-benzothiazolinylidene)-2-butenylidene]- (6CI, 7CI)
• Molecular Formula: C₁₆H₁₃N₃S
• Molecular Weight: 279.36
• CAS Registry Number: 92872-47-4
• SMILES: CCN1c2ccccc2SC1=CC=CC=C(C#N)C#N
• InChI: 1S/C16H13N3S/c1-2-19-14-8-4-5-9-15(14)20-16(19)10-6-3-7-13(11-17)12-18/h3-10H,2H2,1H3/b6-3+,16-10-
• InChIKey: HIXPNNNASZSXJD-RFUMYBEHSA-N

Properties

• Density: 1.269g/cm³ (Cal.)
• Boiling point: 393.651°C at 760 mmHg (Cal.)
• Flash point: 191.874°C (Cal.)