4-Amino-5-Bromo-1-[(2S,5R)-2-(Hydroxymethyl)-1,3-Oxathiolan-5-Yl]Pyrimidin-2-One
[CAS# 137530-43-9]

Identification

• Name: 4-Amino-5-Bromo-1-[(2S,5R)-2-(Hydroxymethyl)-1,3-Oxathiolan-5-Yl]Pyrimidin-2-One
• Synonyms: 4-Amino-5-Bromo-1-[(2S,5R)-2-(Hydroxymethyl)-1,3-Oxathiolan-5-Yl]-2-Pyrimidinone; 4-Amino-5-Bromo-1-[(2S,5R)-2-Methylol-1,3-Oxathiolan-5-Yl]Pyrimidin-2-One; Dls-021
• Molecular Formula: C₈H₁₀BrN₃O₃S
• Molecular Weight: 308.15
• CAS Registry Number: 137530-43-9
• SMILES: [C@@H]2(N1C(N=C(C(=C1)Br)N)=O)O[C@@H](SC2)CO
• InChI: 1S/C8H10BrN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)/t5-,6+/m1/s1
• InChIKey: QDHJQKGCCKOBKX-RITPCOANSA-N

Properties

• Density: 2.128g/cm³ (Cal.)
• Boiling point: 490.056°C at 760 mmHg (Cal.)
• Flash point: 250.177°C (Cal.)