N-(3-Methyl-isothiazolyl-4)methyl-guanidine hemi-sulfate
[CAS# 40064-56-0]

Identification

• Name: N-(3-Methyl-isothiazolyl-4)methyl-guanidine hemi-sulfate
• Synonyms: 2-[(3-Methylisothiazol-4-Yl)Methyl]Guanidine; 2-[(3-Methylisothiazol-4-Yl)Methyl]Guanidine; Sulfuric Acid; 2-[(3-Methyl-4-Isothiazolyl)Methyl]Guanidine; 2-[(3-Methyl-4-Isothiazolyl)Methyl]Guanidine; Sulfuric Acid
• Molecular Formula: C₁₂H₂₂N₈O₄S₃
• Molecular Weight: 438.54
• CAS Registry Number: 40064-56-0
• SMILES: C1=C(C(=NS1)C)CN=C(N)N.C2=C(C(=NS2)C)CN=C(N)N.O=[S](O)(O)=O
• InChI: 1S/2C6H10N4S.H2O4S/c2*1-4-5(3-11-10-4)2-9-6(7)8;1-5(2,3)4/h2*3H,2H2,1H3,(H4,7,8,9);(H2,1,2,3,4)
• InChIKey: CVDILRDBIZUZBG-UHFFFAOYSA-N

Properties

• Boiling point: 259.5°C at 760 mmHg (Cal.)
• Flash point: 110.7°C (Cal.)