3-[(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl]-4-Methyl-5-Thiazolidineethanol Dihydrogen Phosphate
[CAS# 60689-64-7]

Identification

• Name: 3-[(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl]-4-Methyl-5-Thiazolidineethanol Dihydrogen Phosphate
• Synonyms: 2-[3-[(4-Amino-2-Methyl-Pyrimidin-5-Yl)Methyl]-4-Methyl-Thiazolidin-5-Yl]Ethyl Dihydrogen Phosphate; 2-[3-[(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl]-4-Methyl-5-Thiazolidinyl]Ethyl Dihydrogen Phosphate; 2-[3-[(4-Amino-2-Methyl-Pyrimidin-5-Yl)Methyl]-4-Methyl-1,3-Thiazolidin-5-Yl]Ethyl Dihydrogen Phosphate
• Molecular Formula: C₁₂H₂₁N₄O₄PS
• Molecular Weight: 348.36
• CAS Registry Number: 60689-64-7
• SMILES: C2=C(CN1CSC(C1C)CCO[P](=O)(O)O)C(=NC(=N2)C)N
• InChI: 1S/C12H21N4O4PS/c1-8-11(3-4-20-21(17,18)19)22-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,8,11H,3-4,6-7H2,1-2H3,(H2,13,14,15)(H2,17,18,19)
• InChIKey: JACGOYDLTZHGRT-UHFFFAOYSA-N

Properties

• Density: 1.418g/cm³ (Cal.)
• Boiling point: 567.411°C at 760 mmHg (Cal.)
• Flash point: 296.96°C (Cal.)