2-(4-Pyrimidinyl)-1,3-benzothiazole
[CAS# 99867-06-8]

Identification

• Name: 2-(4-Pyrimidinyl)-1,3-benzothiazole
• Synonyms: 2-(pyrimidin-4-yl)benzo[d]thiazole
• Molecular Formula: C₁₁H₇N₃S
• Molecular Weight: 213.26
• CAS Registry Number: 99867-06-8
• SMILES: C1=CC=C2C(=C1)N=C(S2)C3=NC=NC=C3
• InChI: 1S/C11H7N3S/c1-2-4-10-8(3-1)14-11(15-10)9-5-6-12-7-13-9/h1-7H
• InChIKey: JHOYIPRFLVMLCC-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 398.7±34.0°C at 760 mmHg (Cal.)
• Flash point: 193.1±16.0°C (Cal.)