[2-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl][4-(methylsulfanyl)phenyl]methanone
[CAS# 898755-95-8]

Identification

• Name: [2-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl][4-(methylsulfanyl)phenyl]methanone
• Synonyms: 2-[8-(1,4-dioxa-8-azaspiro[4.5]decyl)methyl]-4'-thiomethyl benzophenone
• Molecular Formula: C₂₂H₂₅NO₃S
• Molecular Weight: 383.50
• CAS Registry Number: 898755-95-8
• SMILES: CSc1ccc(cc1)C(=O)c4ccccc4CN2CCC3(CC2)OCCO3
• InChI: 1S/C22H25NO3S/c1-27-19-8-6-17(7-9-19)21(24)20-5-3-2-4-18(20)16-23-12-10-22(11-13-23)25-14-15-26-22/h2-9H,10-16H2,1H3
• InChIKey: HUKLBGMFOQOECT-UHFFFAOYSA-N

Properties

• Density: 1.258g/cm³ (Cal.)
• Boiling point: 559.445°C at 760 mmHg (Cal.)
• Flash point: 292.142°C (Cal.)
• Refractive index: 1.635 (Cal.)