2-Amino-9-[(2S,3S,4S)-2-Fluoro-3-Hydroxy-4-(Hydroxymethyl)Cyclopentyl]-3H-Purin-6-One
[CAS# 110289-24-2]

Identification

• Name: 2-Amino-9-[(2S,3S,4S)-2-Fluoro-3-Hydroxy-4-(Hydroxymethyl)Cyclopentyl]-3H-Purin-6-One
• Synonyms: 2-Amino-9-[(2S,3S,4S)-2-Fluoro-3-Hydroxy-4-Methylol-Cyclopentyl]-3H-Purin-6-One; 2-Adhcp; 2-Amino-1,9-Dihydro-9-(2-Fluoro-3-Hydroxy-4-(Hydroxymethyl)Cyclopentyl)-6H-Purin-6-One
• Molecular Formula: C₁₁H₁₄FN₅O₃
• Molecular Weight: 283.26
• CAS Registry Number: 110289-24-2
• SMILES: [N]1(C=NC2=C1NC(=NC2=O)N)C3[C@@H]([C@H]([C@@H](C3)CO)O)F
• InChI: 1S/C11H14FN5O3/c12-6-5(1-4(2-18)8(6)19)17-3-14-7-9(17)15-11(13)16-10(7)20/h3-6,8,18-19H,1-2H2,(H3,13,15,16,20)/t4-,5?,6-,8-/m0/s1
• InChIKey: RAXDGCQXNUHPMZ-FFFSVUEPSA-N

Properties

• Density: 2.014g/cm³ (Cal.)
• Boiling point: 665.658°C at 760 mmHg (Cal.)
• Flash point: 356.377°C (Cal.)