Acetic Acid
[CAS# 13467-26-0]

Identification

• Name: Acetic Acid
• Synonyms: Acetic Acid; 2-[(2-Aminoacetyl)Amino]-3-Phenyl-Propanamide; Acetic Acid; 2-[(2-Amino-1-Oxoethyl)Amino]-3-Phenylpropanamide; Acetic Acid; 2-(Glycylamino)-3-Phenyl-Propionamide
• Molecular Formula: C₁₃H₁₉N₃O₄
• Molecular Weight: 281.31
• CAS Registry Number: 13467-26-0
• SMILES: C1=CC=CC=C1CC(NC(CN)=O)C(N)=O.CC(O)=O
• InChI: 1S/C11H15N3O2.C2H4O2/c12-7-10(15)14-9(11(13)16)6-8-4-2-1-3-5-8;1-2(3)4/h1-5,9H,6-7,12H2,(H2,13,16)(H,14,15);1H3,(H,3,4)
• InChIKey: UFYWNVUEIJKEMY-UHFFFAOYSA-N

Properties

• Boiling point: 540.6°C at 760 mmHg (Cal.)
• Flash point: 280.7°C (Cal.)