4-[(2-Amino-4-Oxo-1H-Pteridin-6-Yl)Methyl-Formylamino]Benzoic Acid
[CAS# 119-20-0]

Identification

• Name: 4-[(2-Amino-4-Oxo-1H-Pteridin-6-Yl)Methyl-Formylamino]Benzoic Acid
• Synonyms: 4-[(2-Amino-4-Oxo-1H-Pteridin-6-Yl)Methyl-Formyl-Amino]Benzoic Acid; 4-[(2-Amino-4-Keto-1H-Pteridin-6-Yl)Methyl-Formyl-Amino]Benzoic Acid; 4-[(2-Amino-4-Oxo-1H-Pteridin-6-Yl)Methyl-Methanoyl-Amino]Benzoic Acid
• Molecular Formula: C₁₅H₁₂N₆O₄
• Molecular Weight: 340.30
• CAS Registry Number: 119-20-0
• SMILES: C1=NC3=C(N=C1CN(C=O)C2=CC=C(C=C2)C(O)=O)C(=O)N=C(N3)N
• InChI: 1S/C15H12N6O4/c16-15-19-12-11(13(23)20-15)18-9(5-17-12)6-21(7-22)10-3-1-8(2-4-10)14(24)25/h1-5,7H,6H2,(H,24,25)(H3,16,17,19,20,23)
• InChIKey: RCJIVJMTTMAMME-UHFFFAOYSA-N

Properties

• Density: 1.668g/cm³ (Cal.)
• Boiling point: 743.345°C at 760 mmHg (Cal.)
• Flash point: 403.361°C (Cal.)