(4E)-4-[(2-(1,3-Benzothiazol-2-yl)hydrazinyl)methylidene]-2-hydroxycyclohexa-2,5-dien-1-one
[CAS# 5491-96-3]

Identification

• Name: (4E)-4-[(2-(1,3-Benzothiazol-2-yl)hydrazinyl)methylidene]-2-hydroxycyclohexa-2,5-dien-1-one
• Synonyms: (4E)-4-[(N'-(1,3-Benzothiazol-2-Yl)Hydrazino)Methylene]-2-Hydroxy-Cyclohexa-2,5-Dien-1-One; (4E)-4-[(N'-(1,3-Benzothiazol-2-Yl)Hydrazino)Methylene]-2-Hydroxy-1-Cyclohexa-2,5-Dienone; (4E)-4-[(2-(1,3-Benzothiazol-2-Yl)Hydrazinyl)Methylidene]-2-Hydroxy-Cyclohexa-2,5-Dien-1-One
• Molecular Formula: C₁₄H₁₁N₃O₂S
• Molecular Weight: 285.32
• CAS Registry Number: 5491-96-3
• SMILES: C2=C1SC(=NC1=CC=C2)NN/C=C3/C=C(O)C(=O)C=C3
• InChI: 1S/C14H11N3O2S/c18-11-6-5-9(7-12(11)19)8-15-17-14-16-10-3-1-2-4-13(10)20-14/h1-8,15,19H,(H,16,17)/b9-8+
• InChIKey: BJIMFOWYXRWUQA-CMDGGOBGSA-N

Properties

• Density: 1.633g/cm³ (Cal.)
• Boiling point: 471.231°C at 760 mmHg (Cal.)
• Flash point: 238.792°C (Cal.)