3-Deaza-4-Deoxyuridine
[CAS# 5116-37-0]

Identification

• Name: 3-Deaza-4-Deoxyuridine
• Synonyms: 1-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Pyridin-2-One; 1-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-2-Pyridinone; 1-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-2-Pyridone
• Molecular Formula: C₁₀H₁₃NO₅
• Molecular Weight: 227.22
• CAS Registry Number: 5116-37-0
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)CO)N2C(=O)C=CC=C2
• InChI: 1S/C10H13NO5/c12-5-6-8(14)9(15)10(16-6)11-4-2-1-3-7(11)13/h1-4,6,8-10,12,14-15H,5H2/t6-,8-,9-,10-/m1/s1
• InChIKey: HQOCNHILQYLGGE-PEBGCTIMSA-N

Properties

• Density: 1.55g/cm³ (Cal.)
• Boiling point: 570.784°C at 760 mmHg (Cal.)
• Flash point: 298.999°C (Cal.)