3-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoic acid
[CAS# 869943-40-8]

Identification

• Name: 3-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoic acid
• Synonyms: 3-(5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-propanoic acid; 3-(5-methyl-1,3,4-thiadiazol-2-ylthio)propanoic acid; 3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]propanoic acid
• Molecular Formula: C₆H₈N₂O₂S₂
• Molecular Weight: 204.27
• CAS Registry Number: 869943-40-8
• SMILES: OC(=O)CCSc1nnc(C)s1
• InChI: 1S/C6H8N2O2S2/c1-4-7-8-6(12-4)11-3-2-5(9)10/h2-3H2,1H3,(H,9,10)
• InChIKey: BZEBUBGIZUJFKS-UHFFFAOYSA-N

Properties

• Density: 1.46g/cm³ (Cal.)
• Boiling point: 415.271°C at 760 mmHg (Cal.)
• Flash point: 204.949°C (Cal.)
• Refractive index: 1.612 (Cal.)

Safety Data

• Safety Description: IRRITANT