Ethyl 4-oxo-4-[3-(4-thiomorpholinylmethyl)phenyl]butanoate
[CAS# 898788-17-5]

Identification

• Name: Ethyl 4-oxo-4-[3-(4-thiomorpholinylmethyl)phenyl]butanoate
• Synonyms: ethyl 4-oxo-4-[3-(thiomorpholinomethyl)phenyl]butyrate
• Molecular Formula: C₁₇H₂₃NO₃S
• Molecular Weight: 321.43
• CAS Registry Number: 898788-17-5
• SMILES: CCOC(=O)CCC(=O)c2cc(CN1CCSCC1)ccc2
• InChI: 1S/C17H23NO3S/c1-2-21-17(20)7-6-16(19)15-5-3-4-14(12-15)13-18-8-10-22-11-9-18/h3-5,12H,2,6-11,13H2,1H3
• InChIKey: OXHWWDKZKZANPS-UHFFFAOYSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 476.253°C at 760 mmHg (Cal.)
• Flash point: 241.829°C (Cal.)
• Refractive index: 1.562 (Cal.)