N-[(9,10-Dihydro-4-Hydroxy-9,10-Dioxoanthracen)-1-Yl]-beta-Alanine Methyl Ester
[CAS# 71720-87-1]

Identification

• Name: N-[(9,10-Dihydro-4-Hydroxy-9,10-Dioxoanthracen)-1-Yl]-beta-Alanine Methyl Ester
• Synonyms: Methyl 3-[(4-Hydroxy-9,10-Dioxo-1-Anthryl)Amino]Propanoate; 3-[(4-Hydroxy-9,10-Dioxo-1-Anthryl)Amino]Propanoic Acid Methyl Ester; 3-[(4-Hydroxy-9,10-Diketo-1-Anthryl)Amino]Propionic Acid Methyl Ester
• Molecular Formula: C₁₈H₁₅NO₅
• Molecular Weight: 325.32
• CAS Registry Number: 71720-87-1
• SMILES: C1=CC(=C2C(=C1NCCC(OC)=O)C(=O)C3=C(C2=O)C=CC=C3)O
• InChI: 1S/C18H15NO5/c1-24-14(21)8-9-19-12-6-7-13(20)16-15(12)17(22)10-4-2-3-5-11(10)18(16)23/h2-7,19-20H,8-9H2,1H3
• InChIKey: YPAXZARCKVMKEA-UHFFFAOYSA-N

Properties

• Density: 1.415g/cm³ (Cal.)
• Boiling point: 578.65°C at 760 mmHg (Cal.)
• Flash point: 303.757°C (Cal.)