{4-[(Chloroacetyl)amino]phenyl}acetic acid
[CAS# 90798-99-5]

Identification

• Name: {4-[(Chloroacetyl)amino]phenyl}acetic acid
• Synonyms: {4-[(chloroacetyl)amino]phenyl}acetic acid; {4-[(CHLOROACETYL)AMINO]PHENYL}ACETICACID; 2-(4-(2-chloroacetamido)phenyl)acetic acid
• Molecular Formula: C₁₀H₁₀ClNO₃
• Molecular Weight: 227.64
• CAS Registry Number: 90798-99-5
• SMILES: O=C(O)Cc1ccc(cc1)NC(=O)CCl
• InChI: 1S/C10H10ClNO3/c11-6-9(13)12-8-3-1-7(2-4-8)5-10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)
• InChIKey: DMQOFZHHYJUHLL-UHFFFAOYSA-N

Properties

• Density: 1.411g/cm³ (Cal.)
• Boiling point: 477.589°C at 760 mmHg (Cal.)
• Flash point: 242.637°C (Cal.)

Safety Data

• Safety Description: IRRITANT