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| Name | 4-[(2,4-Diaminopteridin-6-Yl)Methylamino]Benzoic Acid |
|---|---|
| Synonyms | 4-[(2,4-Diamino-6-Pteridinyl)Methylamino]Benzoic Acid; 4-(N-((2,4-Diamino-6-Pteridinyl)Methyl)Amino)Benzoic Acid; 4-Pmab |
| Molecular Structure | ![CAS#: 36093-85-3， 4-[(2,4-Diaminopteridin-6-Yl)Methylamino]Benzoic Acid](/moreStructures/36093-85-3.gif) |
| Molecular Formula | C14H13N7O2 |
| Molecular Weight | 311.30 |
| CAS Registry Number | 36093-85-3 |
| SMILES | C1=NC3=C(N=C1CNC2=CC=C(C(O)=O)C=C2)C(=NC(=N3)N)N |
| InChI | 1S/C14H13N7O2/c15-11-10-12(21-14(16)20-11)18-6-9(19-10)5-17-8-3-1-7(2-4-8)13(22)23/h1-4,6,17H,5H2,(H,22,23)(H4,15,16,18,20,21) |
| InChIKey | OSYSFOFKQDNPGP-UHFFFAOYSA-N |
| Density | 1.607g/cm3 (Cal.) |
|---|---|
| Boiling point | 681.786°C at 760 mmHg (Cal.) |
| Flash point | 366.131°C (Cal.) |
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