5-(Butylthiomethyl)-5-Isobutyl-2-Sodiooxy-4,6(1H,5H)-Pyrimidinedione
[CAS# 67050-74-2]

Identification

• Name: 5-(Butylthiomethyl)-5-Isobutyl-2-Sodiooxy-4,6(1H,5H)-Pyrimidinedione
• Synonyms: Sodium 5-(Butylsulfanylmethyl)-1-Methyl-5-(2-Methylpropyl)Pyrimidin-3-Ide-2,4,6-Trione; Sodium 5-(Butylsulfanylmethyl)-5-Isobutyl-1-Methyl-4,6-Dioxo-Pyrimidin-2-Olate; Sodium 5-(Butylsulfanylmethyl)-5-Isobutyl-1-Methyl-Hexahydropyrimidin-3-Ide-2,4,6-Trione
• Molecular Formula: C₁₄H₂₃N₂NaO₃S
• Molecular Weight: 322.40
• CAS Registry Number: 67050-74-2
• SMILES: C(C1(C(=O)N(C(=O)[N-]C1=O)C)CSCCCC)C(C)C.[Na+]
• InChI: 1S/C14H24N2O3S.Na/c1-5-6-7-20-9-14(8-10(2)3)11(17)15-13(19)16(4)12(14)18;/h10H,5-9H2,1-4H3,(H,15,17,19);/q;+1/p-1
• InChIKey: LFHGOFISVFPORL-UHFFFAOYSA-M

Properties

• Boiling point: 420.2°C at 760 mmHg (Cal.)
• Flash point: 207.9°C (Cal.)