Modaline
[CAS# 2856-75-9]

Identification

• Name: Modaline
• Synonyms: 2-Methyl-3-(1-Piperidyl)Pyrazine; Sulfuric Acid; 2-Methyl-3-Piperidino-Pyrazine; Sulfuric Acid; 2-Methyl-3-Piperidin-1-Yl-Pyrazine; Sulfuric Acid
• Molecular Formula: C₁₀H₁₇N₃O₄S
• Molecular Weight: 275.32
• CAS Registry Number: 2856-75-9
• SMILES: O=[S](=O)(O)O.C1=CN=C(C(=N1)N2CCCCC2)C
• InChI: 1S/C10H15N3.H2O4S/c1-9-10(12-6-5-11-9)13-7-3-2-4-8-13;1-5(2,3)4/h5-6H,2-4,7-8H2,1H3;(H2,1,2,3,4)
• InChIKey: GJXZNORUUOVBKP-UHFFFAOYSA-N

Properties

• Boiling point: 294.2°C at 760 mmHg (Cal.)
• Flash point: 131.7°C (Cal.)