alpha,alpha,2-Trimethyl-5-Benzothiazolemethanol
[CAS# 5935-85-3]

Identification

• Name: alpha,alpha,2-Trimethyl-5-Benzothiazolemethanol
• Molecular Formula: C₂₇H₂₅FN₂O₂
• Molecular Weight: 428.51
• CAS Registry Number: 5935-85-3
• SMILES: C1=CC(=CC=C1F)C[N]2C(=CC=C2)CN(CC3=CC=CC=C3)C(=O)COC4=CC=CC=C4
• InChI: 1S/C27H25FN2O2/c28-24-15-13-23(14-16-24)18-29-17-7-10-25(29)20-30(19-22-8-3-1-4-9-22)27(31)21-32-26-11-5-2-6-12-26/h1-17H,18-21H2
• InChIKey: NGTUEGVJHJELSL-UHFFFAOYSA-N

Properties

• Density: 1.124g/cm³ (Cal.)
• Boiling point: 613.508°C at 760 mmHg (Cal.)
• Flash point: 324.838°C (Cal.)