CAS | 58-61-7 |
Structure | |
Synonyms | Adenine-9-1'-β-ribofuranoside |
IUPAC Name | (2R,3R,4S,5R)-2-(6-Aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol |
Molecular Weight | 267.24 |
Molecular Formula | C10H13N5O4 |
Canonical SMILES | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N |
InChI | InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1 |
InChI Key | OIRDTQYFTABQOQ-KQYNXXCUSA-N |
Boiling Point | 410.43 °C |
Melting Point | 234-236 °C(lit.) |
Purity | 99% |
Density | 1.3382 g/cm³ |
Refractive Index | 1.7610 |
pKa | pK1:3.6, pK2:12.4 (25°C) |
Appearance | White crystalline powder |
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