2-[[4-[(2-Bromoacetyl)Amino]Benzoyl]Amino]Acetic Acid
[CAS# 158039-67-9]

Identification

• Name: 2-[[4-[(2-Bromoacetyl)Amino]Benzoyl]Amino]Acetic Acid
• Synonyms: 2-[[[4-[(2-Bromo-1-Oxoethyl)Amino]Phenyl]-Oxomethyl]Amino]Acetic Acid; 2-[[4-(2-Bromoethanoylamino)Phenyl]Carbonylamino]Ethanoic Acid; Bracpah
• Molecular Formula: C₁₁H₁₁BrN₂O₄
• Molecular Weight: 315.12
• CAS Registry Number: 158039-67-9
• SMILES: C1=CC(=CC=C1C(NCC(=O)O)=O)NC(=O)CBr
• InChI: 1S/C11H11BrN2O4/c12-5-9(15)14-8-3-1-7(2-4-8)11(18)13-6-10(16)17/h1-4H,5-6H2,(H,13,18)(H,14,15)(H,16,17)
• InChIKey: UUZWTKPHANMVFF-UHFFFAOYSA-N

Properties

• Density: 1.684g/cm³ (Cal.)
• Boiling point: 628.412°C at 760 mmHg (Cal.)
• Flash point: 333.852°C (Cal.)