Ammonium mandelate
[CAS 530-31-4]

Identification

• Name: Ammonium mandelate
• Synonyms: Ammonia; 2-Hydroxy-2-Phenyl-Acetic Acid; Ammonia; 2-Hydroxy-2-Phenylacetic Acid; Azane; 2-Hydroxy-2-Phenyl-Ethanoic Acid
• Molecular Formula: C₈H₁₁NO₃
• Molecular Weight: 169.18
• CAS Registry Number: 530-31-4
• EINECS: 208-475-8
• SMILES: C1=CC=CC=C1C(C(=O)O)O.N
• InChI: 1S/C8H8O3.H3N/c9-7(8(10)11)6-4-2-1-3-5-6;/h1-5,7,9H,(H,10,11);1H3
• InChIKey: BDEXTKUJIZCFST-UHFFFAOYSA-N

Properties

• Boiling point: 321.8°C at 760 mmHg (Cal.)
• Flash point: 162.6°C (Cal.)