Ethyl 5-oxo-5-[4-(4-thiomorpholinylmethyl)phenyl]pentanoate
[CAS# 898783-38-5]

Identification

• Name: Ethyl 5-oxo-5-[4-(4-thiomorpholinylmethyl)phenyl]pentanoate
• Synonyms: ethyl 5-oxo-5-[4-(thiomorpholinomethyl)phenyl]valerate
• Molecular Formula: C₁₈H₂₅NO₃S
• Molecular Weight: 335.46
• CAS Registry Number: 898783-38-5
• SMILES: CCOC(=O)CCCC(=O)c1ccc(cc1)CN2CCSCC2
• InChI: 1S/C18H25NO3S/c1-2-22-18(21)5-3-4-17(20)16-8-6-15(7-9-16)14-19-10-12-23-13-11-19/h6-9H,2-5,10-14H2,1H3
• InChIKey: SQPFTGXBNUGMKG-UHFFFAOYSA-N

Properties

• Density: 1.146g/cm³ (Cal.)
• Boiling point: 488.649°C at 760 mmHg (Cal.)
• Flash point: 249.326°C (Cal.)
• Refractive index: 1.557 (Cal.)