4-[Methyl[(2-Amino-4-Hydroxypteridine)-6-Ylmethyl]Amino]Benzoic Acid
[CAS# 5623-18-7]

Identification

• Name: 4-[Methyl[(2-Amino-4-Hydroxypteridine)-6-Ylmethyl]Amino]Benzoic Acid
• Synonyms: 4-[(2-Amino-4-Oxo-1H-Pteridin-6-Yl)Methyl-Methyl-Amino]Benzoic Acid; 4-[(2-Amino-4-Keto-1H-Pteridin-6-Yl)Methyl-Methyl-Amino]Benzoic Acid; Benzoic Acid, 4-(((2-Amino-1,4-Dihydro-4-Oxo-6-Pteridinyl)Methyl)Methylamino)- (9Ci)
• Molecular Formula: C₁₅H₁₄N₆O₃
• Molecular Weight: 326.31
• CAS Registry Number: 5623-18-7
• SMILES: C1=NC3=C(N=C1CN(C)C2=CC=C(C=C2)C(O)=O)C(=O)N=C(N3)N
• InChI: 1S/C15H14N6O3/c1-21(10-4-2-8(3-5-10)14(23)24)7-9-6-17-12-11(18-9)13(22)20-15(16)19-12/h2-6H,7H2,1H3,(H,23,24)(H3,16,17,19,20,22)
• InChIKey: QHNLFEQJGRZKTK-UHFFFAOYSA-N

Properties

• Density: 1.585g/cm³ (Cal.)
• Boiling point: 668.257°C at 760 mmHg (Cal.)
• Flash point: 357.949°C (Cal.)