10-[2-(1-Methyl-2-Piperidinyl)Ethyl]-2-(Methylsulfanyl)-10H-Phenothiazine
[CAS# 114488-10-7]

Identification

• Name: 10-[2-(1-Methyl-2-Piperidinyl)Ethyl]-2-(Methylsulfanyl)-10H-Phenothiazine
• Synonyms: (±)-Thioridazine; 10-(2-(1-Methyl-2-piperidyl)ethyl)-2-(methylthio)phenothiazine
• Molecular Formula: C₂₁H₂₆N₂S₂
• Molecular Weight: 370.57
• CAS Registry Number: 114488-10-7
• SMILES: CN1CCCCC1CCN2C3=CC=CC=C3SC4=C2C=C(C=C4)SC
• InChI: 1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
• InChIKey: KLBQZWRITKRQQV-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 515.7±50.0°C at 760 mmHg (Cal.)
• Flash point: 265.7±30.1°C (Cal.)
• Refractive index: 1.677 (Cal.)

References

• (1): Eduardo Costa Figueiredo, Gustavo Braga Sanvido, Marco Aurélio Zezzi Arruda and Marcos Nogueira Eberlin. Molecularly imprinted polymers as analyte sequesters and selective surfaces for easy ambient sonic-spray ionization, Analyst, 2010, 135, 726.