5-(Phenoxymethyl)Thiadiazole-4-Carboxylic Acid
[CAS# 4609-51-2]

Identification

• Name: 5-(Phenoxymethyl)Thiadiazole-4-Carboxylic Acid
• Synonyms: 5-(Phenoxymethyl)-4-Thiadiazolecarboxylic Acid; 5-(Phenoxymethyl)-1,2,3-Thiadiazole-4-Carboxylic Acid; Nsc48744
• Molecular Formula: C₁₀H₈N₂O₃S
• Molecular Weight: 236.24
• CAS Registry Number: 4609-51-2
• SMILES: C1=CC=CC=C1OCC2=C(N=NS2)C(O)=O
• InChI: 1S/C10H8N2O3S/c13-10(14)9-8(16-12-11-9)6-15-7-4-2-1-3-5-7/h1-5H,6H2,(H,13,14)
• InChIKey: JZISXVMNFQBQQJ-UHFFFAOYSA-N

Properties

• Density: 1.453g/cm³ (Cal.)
• Boiling point: 428.057°C at 760 mmHg (Cal.)
• Flash point: 212.682°C (Cal.)