Ethyl 8-[4-(1-azetidinylmethyl)phenyl]-8-oxooctanoate
[CAS# 898757-31-8]

Identification

• Name: Ethyl 8-[4-(1-azetidinylmethyl)phenyl]-8-oxooctanoate
• Synonyms: ethyl 8-[4-(azetidinomethyl)phenyl]-8-oxooctanoate
• Molecular Formula: C₂₀H₂₉NO₃
• Molecular Weight: 331.45
• CAS Registry Number: 898757-31-8
• SMILES: CCOC(=O)CCCCCCC(=O)c2ccc(CN1CCC1)cc2
• InChI: 1S/C20H29NO3/c1-2-24-20(23)9-6-4-3-5-8-19(22)18-12-10-17(11-13-18)16-21-14-7-15-21/h10-13H,2-9,14-16H2,1H3
• InChIKey: MWYNMELXGAXPLY-UHFFFAOYSA-N

Properties

• Density: 1.078g/cm³ (Cal.)
• Boiling point: 451.874°C at 760 mmHg (Cal.)
• Flash point: 227.085°C (Cal.)
• Refractive index: 1.533 (Cal.)