1,1'-(p-Phenylenebis(ureylene-p-phenylene))bis(3-methyl-1H-1,2,3-Triazolium bis(methyl sulfate)
[CAS# 67013-99-4]

Identification

• Name: 1,1'-(p-Phenylenebis(ureylene-p-phenylene))bis(3-methyl-1H-1,2,3-Triazolium bis(methyl sulfate)
• Synonyms: 4-Amino-1-[(2R,3S,4S,5R)-3-Amino-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Pyrimidin-2-One; 4-Amino-1-[(2R,3S,4S,5R)-3-Amino-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-2-Pyrimidinone; 4-Amino-1-[(2R,3S,4S,5R)-3-Amino-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]Pyrimidin-2-One
• Molecular Formula: C₉H₁₄N₄O₄
• Molecular Weight: 242.23
• CAS Registry Number: 67013-99-4
• SMILES: [C@H]2(N1C(N=C(C=C1)N)=O)[C@H]([C@H](O)[C@H](O2)CO)N
• InChI: 1S/C9H14N4O4/c10-5-1-2-13(9(16)12-5)8-6(11)7(15)4(3-14)17-8/h1-2,4,6-8,14-15H,3,11H2,(H2,10,12,16)/t4-,6+,7-,8-/m1/s1
• InChIKey: FECRKKQKJNKYNF-PXBUCIJWSA-N

Properties

• Density: 1.893g/cm³ (Cal.)
• Boiling point: 531.257°C at 760 mmHg (Cal.)
• Flash point: 275.095°C (Cal.)