(E)-1-beta-D-Arabinofuranosyl-5-(2-bromoethenyl)-2,4(1H,3H)-pyrimidinedione
[CAS# 80434-16-8]

Identification

• Name: (E)-1-beta-D-Arabinofuranosyl-5-(2-bromoethenyl)-2,4(1H,3H)-pyrimidinedione
• Synonyms: 5-[(E)-2-Bromovinyl]-1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Pyrimidine-2,4-Dione; 5-[(E)-2-Bromovinyl]-1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]Pyrimidine-2,4-Dione; 5-[(E)-2-Bromovinyl]-1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]Pyrimidine-2,4-Quinone
• Molecular Formula: C₁₁H₁₃BrN₂O₆
• Molecular Weight: 349.14
• CAS Registry Number: 80434-16-8
• SMILES: [C@@H]2(N1C=C(C(=O)NC1=O)\C=C\Br)O[C@H](CO)[C@H]([C@@H]2O)O
• InChI: 1S/C11H13BrN2O6/c12-2-1-5-3-14(11(19)13-9(5)18)10-8(17)7(16)6(4-15)20-10/h1-3,6-8,10,15-17H,4H2,(H,13,18,19)/b2-1+/t6-,7-,8+,10-/m1/s1
• InChIKey: GCQYYIHYQMVWLT-HQNLTJAPSA-N

Properties

• Density: 1.98g/cm³ (Cal.)