2-Piperidinoethyl 3-(Propylthio)Benzoate
[CAS# 67031-80-5]

Identification

• Name: 2-Piperidinoethyl 3-(Propylthio)Benzoate
• Synonyms: 2-(1-Piperidyl)Ethyl 3-Propylsulfanylbenzoate; 3-(Propylthio)Benzoic Acid 2-(1-Piperidyl)Ethyl Ester; 3-(Propylthio)Benzoic Acid 2-Piperidinoethyl Ester
• Molecular Formula: C₁₇H₂₅NO₂S
• Molecular Weight: 307.45
• CAS Registry Number: 67031-80-5
• SMILES: C2=C(C(OCCN1CCCCC1)=O)C=CC=C2SCCC
• InChI: 1S/C17H25NO2S/c1-2-13-21-16-8-6-7-15(14-16)17(19)20-12-11-18-9-4-3-5-10-18/h6-8,14H,2-5,9-13H2,1H3
• InChIKey: PEHIRBVKWKSOOU-UHFFFAOYSA-N

Properties

• Density: 1.119g/cm³ (Cal.)
• Boiling point: 439.226°C at 760 mmHg (Cal.)
• Flash point: 219.436°C (Cal.)