4,6-Bis(Benzylsulfanyl)-5-Bromo-Pyrimidine
[CAS# 6308-36-7]

Identification

• Name: 4,6-Bis(Benzylsulfanyl)-5-Bromo-Pyrimidine
• Synonyms: 5-Bromo-4,6-Bis(Phenylmethylthio)Pyrimidine; 4,6-Bis(Benzylthio)-5-Bromo-Pyrimidine; Nsc42026
• Molecular Formula: C₁₈H₁₅BrN₂S₂
• Molecular Weight: 403.35
• CAS Registry Number: 6308-36-7
• SMILES: C1=CC=CC=C1CSC2=NC=NC(=C2Br)SCC3=CC=CC=C3
• InChI: 1S/C18H15BrN2S2/c19-16-17(22-11-14-7-3-1-4-8-14)20-13-21-18(16)23-12-15-9-5-2-6-10-15/h1-10,13H,11-12H2
• InChIKey: KJHDCRDWBIUJRN-UHFFFAOYSA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 513.931°C at 760 mmHg (Cal.)
• Flash point: 264.616°C (Cal.)