4-Amino-3-ethoxy-1,2-thiazole-5-carbonitrile 1,1-dioxide
[CAS# 85194-91-8]

Identification

• Name: 4-Amino-3-ethoxy-1,2-thiazole-5-carbonitrile 1,1-dioxide
• Synonyms: 4-amino-3-ethoxyisothiazole-5-carbonitrile 1,1-dioxide
• Molecular Formula: C₆H₇N₃O₃S
• Molecular Weight: 201.20
• CAS Registry Number: 85194-91-8
• SMILES: O=S1(=O)/N=C(/OCC)\C(\N)=C1\C#N
• InChI: 1S/C6H7N3O3S/c1-2-12-6-5(8)4(3-7)13(10,11)9-6/h2,8H2,1H3
• InChIKey: WRESMECTRBMCPU-UHFFFAOYSA-N

Properties

• Density: 1.612g/cm³ (Cal.)
• Boiling point: 383.201°C at 760 mmHg (Cal.)
• Flash point: 185.554°C (Cal.)