N6-(1,2-Dicarboxyethyl)-Amp
[CAS# 19240-42-7]

Identification

• Name: N6-(1,2-Dicarboxyethyl)-Amp
• Synonyms: 2-[[9-[3,4-Dihydroxy-5-(Phosphonooxymethyl)Tetrahydrofuran-2-Yl]Purin-6-Yl]Amino]Butanedioic Acid; 2-[[9-[3,4-Dihydroxy-5-(Phosphonooxymethyl)-2-Tetrahydrofuranyl]-6-Purinyl]Amino]Butanedioic Acid; 2-[[9-[3,4-Dihydroxy-5-(Phosphonooxymethyl)Tetrahydrofuran-2-Yl]Purin-6-Yl]Amino]Succinic Acid
• Molecular Formula: C₁₄H₁₈N₅O₁₁P
• Molecular Weight: 463.30
• CAS Registry Number: 19240-42-7
• SMILES: C1=NC3=C([N]1C2OC(CO[P](O)(O)=O)C(C2O)O)N=CN=C3NC(CC(O)=O)C(O)=O
• InChI: 1S/C14H18N5O11P/c20-7(21)1-5(14(24)25)18-11-8-12(16-3-15-11)19(4-17-8)13-10(23)9(22)6(30-13)2-29-31(26,27)28/h3-6,9-10,13,22-23H,1-2H2,(H,20,21)(H,24,25)(H,15,16,18)(H2,26,27,28)
• InChIKey: OFBHPPMPBOJXRT-UHFFFAOYSA-N

Properties

• Density: 2.198g/cm³ (Cal.)
• Boiling point: 921.858°C at 760 mmHg (Cal.)
• Flash point: 511.321°C (Cal.)