4-Hydroxytriamterene
[CAS# 1226-52-4]

Identification

• Name: 4-Hydroxytriamterene
• Synonyms: 4-(2,4,7-Triamino-5H-Pteridin-6-Ylidene)-1-Cyclohexa-2,5-Dienone; 4-Hydroxytriamterene; Phenol, 4-(2,4,7-Triamino-6-Pteridinyl)-
• Molecular Formula: C₁₂H₁₁N₇O
• Molecular Weight: 269.27
• CAS Registry Number: 1226-52-4
• SMILES: C3(=C2NC(=C1C=CC(=O)C=C1)C(=NC2=NC(=N3)N)N)N
• InChI: 1S/C12H11N7O/c13-9-7(5-1-3-6(20)4-2-5)16-8-10(14)18-12(15)19-11(8)17-9/h1-4,16H,(H6,13,14,15,17,18,19)
• InChIKey: FVVQYJRJSSHFNY-UHFFFAOYSA-N

Properties

• Density: 1.835g/cm³ (Cal.)
• Boiling point: 627.087°C at 760 mmHg (Cal.)
• Flash point: 333.05°C (Cal.)