3-Methyl[1,2]Oxazolo[5,4-d]Pyrimidine-4(5H)-Thione
[CAS# 130783-68-5]

Identification

• Name: 3-Methyl[1,2]Oxazolo[5,4-d]Pyrimidine-4(5H)-Thione
• Synonyms: 3-methylisoxazolo[5,4-d]pyrimidine-4(5H)-thione; 3-methylisoxazolo[5,4-d]pyrimidine-4-thiol
• Molecular Formula: C₆H₅N₃OS
• Molecular Weight: 167.19
• CAS Registry Number: 130783-68-5
• SMILES: S=C2N\C=N/c1onc(C)c12
• InChI: 1S/C6H5N3OS/c1-3-4-5(10-9-3)7-2-8-6(4)11/h2H,1H3,(H,7,8,11)
• InChIKey: VBBCIBYTNGQINZ-UHFFFAOYSA-N

Properties

• Density: 1.665g/cm³ (Cal.)
• Boiling point: 361.489°C at 760 mmHg (Cal.)
• Flash point: 172.422°C (Cal.)
• Refractive index: 1.796 (Cal.)