4-Amino-1-[(1S,2R,4R,5S)-4-(Hydroxymethyl)-3,6-Dioxabicyclo[3.1.0]Hexan-2-Yl]Pyrimidin-2-One
[CAS# 34989-27-0]

Identification

• Name: 4-Amino-1-[(1S,2R,4R,5S)-4-(Hydroxymethyl)-3,6-Dioxabicyclo[3.1.0]Hexan-2-Yl]Pyrimidin-2-One
• Synonyms: 4-Amino-1-[(1S,2R,4R,5S)-4-(Hydroxymethyl)-3,6-Dioxabicyclo[3.1.0]Hexan-2-Yl]-2-Pyrimidinone; 4-Amino-1-[(1S,2R,4R,5S)-4-Methylol-3,6-Dioxabicyclo[3.1.0]Hexan-2-Yl]Pyrimidin-2-One; 1-(2,3-Anhydro-Beta-D-Lyxofuranosyl)Cytosine
• Molecular Formula: C₉H₁₁N₃O₄
• Molecular Weight: 225.20
• CAS Registry Number: 34989-27-0
• SMILES: [C@H]1(O[C@H](CO)[C@H]2[C@@H]1O2)N3C(N=C(C=C3)N)=O
• InChI: 1S/C9H11N3O4/c10-5-1-2-12(9(14)11-5)8-7-6(16-7)4(3-13)15-8/h1-2,4,6-8,13H,3H2,(H2,10,11,14)/t4-,6+,7+,8-/m1/s1
• InChIKey: WIPSIZKSUXRXHP-YDKYIBAVSA-N

Properties

• Density: 2.014g/cm³ (Cal.)
• Boiling point: 458.361°C at 760 mmHg (Cal.)
• Flash point: 231.008°C (Cal.)