[4-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl][2-(methylsulfanyl)phenyl]methanone
[CAS# 898757-72-7]

Identification

• Name: [4-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl][2-(methylsulfanyl)phenyl]methanone
• Synonyms: 4'-[8-(1,4-dioxa-8-azaspiro[4.5]decyl)methyl]-2-thiomethyl benzophenone
• Molecular Formula: C₂₂H₂₅NO₃S
• Molecular Weight: 383.50
• CAS Registry Number: 898757-72-7
• SMILES: CSc1ccccc1C(=O)c2ccc(cc2)CN3CCC4(CC3)OCCO4
• InChI: 1S/C22H25NO3S/c1-27-20-5-3-2-4-19(20)21(24)18-8-6-17(7-9-18)16-23-12-10-22(11-13-23)25-14-15-26-22/h2-9H,10-16H2,1H3
• InChIKey: NGNJUJWKXBEPRA-UHFFFAOYSA-N

Properties

• Density: 1.258g/cm³ (Cal.)
• Boiling point: 547.221°C at 760 mmHg (Cal.)
• Flash point: 284.749°C (Cal.)
• Refractive index: 1.635 (Cal.)