N(3)-Benzylthymidine
[CAS# 21473-21-2]

Identification

• Name: N(3)-Benzylthymidine
• Synonyms: 1-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-5-Methyl-3-(Phenylmethyl)Pyrimidine-2,4-Dione; 1-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-5-Methyl-3-(Phenylmethyl)Pyrimidine-2,4-Dione; 3-(Benzyl)-1-[(2R,4S,5R)-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-5-Methyl-Pyrimidine-2,4-Quinone
• Molecular Formula: C₁₇H₂₀N₂O₅
• Molecular Weight: 332.36
• CAS Registry Number: 21473-21-2
• SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO)N2C(=O)N(C(=O)C(=C2)C)CC3=CC=CC=C3
• InChI: 1S/C17H20N2O5/c1-11-8-18(15-7-13(21)14(10-20)24-15)17(23)19(16(11)22)9-12-5-3-2-4-6-12/h2-6,8,13-15,20-21H,7,9-10H2,1H3/t13-,14+,15+/m0/s1
• InChIKey: DBCHBEREBCGAIN-RRFJBIMHSA-N

Properties

• Density: 1.384g/cm³ (Cal.)
• Boiling point: 554.05°C at 760 mmHg (Cal.)
• Flash point: 288.879°C (Cal.)