5-(Butylthiomethyl)-5-Propyl-2-Sodiooxy-4,6(1H,5H)-Pyrimidinedione
[CAS# 67050-77-5]

Identification

• Name: 5-(Butylthiomethyl)-5-Propyl-2-Sodiooxy-4,6(1H,5H)-Pyrimidinedione
• Synonyms: Sodium 5-(Butylsulfanylmethyl)-1-Methyl-4,6-Dioxo-5-Propylpyrimidin-2-Olate; Sodium 5-(Butylsulfanylmethyl)-1-Methyl-4,6-Dioxo-5-Propyl-Pyrimidin-2-Olate; Sodium 5-(Butylsulfanylmethyl)-1-Methyl-5-Propyl-Hexahydropyrimidin-3-Ide-2,4,6-Trione
• Molecular Formula: C₁₃H₂₁N₂NaO₃S
• Molecular Weight: 308.37
• CAS Registry Number: 67050-77-5
• SMILES: C(SCCCC)C1(C(=O)N(C(=O)[N-]C1=O)C)CCC.[Na+]
• InChI: 1S/C13H22N2O3S.Na/c1-4-6-8-19-9-13(7-5-2)10(16)14-12(18)15(3)11(13)17;/h4-9H2,1-3H3,(H,14,16,18);/q;+1/p-1
• InChIKey: AVXXMLLRNKCMIZ-UHFFFAOYSA-M

Properties

• Boiling point: 412.8°C at 760 mmHg (Cal.)
• Flash point: 203.5°C (Cal.)