2-[(2-Aminophenyl)Carbamothioylamino]Acetic Acid
[CAS# 125421-22-9]

Identification

• Name: 2-[(2-Aminophenyl)Carbamothioylamino]Acetic Acid
• Synonyms: 2-[[[(2-Aminophenyl)Amino]-Thioxomethyl]Amino]Acetic Acid; 2-[(2-Aminophenyl)Thiocarbamoylamino]Acetic Acid; 2-[(2-Aminophenyl)Carbamothioylamino]Ethanoic Acid
• Molecular Formula: C₉H₁₁N₃O₂S
• Molecular Weight: 225.26
• CAS Registry Number: 125421-22-9
• SMILES: C1=C(NC(=S)NCC(=O)O)C(=CC=C1)N
• InChI: 1S/C9H11N3O2S/c10-6-3-1-2-4-7(6)12-9(15)11-5-8(13)14/h1-4H,5,10H2,(H,13,14)(H2,11,12,15)
• InChIKey: CZGCMOFGLOQOBE-UHFFFAOYSA-N

Properties

• Density: 1.476g/cm³ (Cal.)
• Boiling point: 430.932°C at 760 mmHg (Cal.)
• Flash point: 214.421°C (Cal.)