8-((2,3-dihydro-8-methoxy-1,4-benzodioxin-2-yl)methyl)-1-Thia-4,8-diazaspiro(4.5)decan-3-one (Z)-2-butenedioate (1:1)
[CAS# 36913-71-0]

Identification

• Name: 8-((2,3-dihydro-8-methoxy-1,4-benzodioxin-2-yl)methyl)-1-Thia-4,8-diazaspiro(4.5)decan-3-one (Z)-2-butenedioate (1:1)
• Synonyms: 1-Thia-4,8-Diazaspiro(4.5)Decan-3-One, 8-((2,3-Dihydro-8-Methoxy-1,4-Benzodioxin-2-Yl)Methyl)-, (Z)-2-Butenedioate (1:1)
• Molecular Formula: C₂₁H₂₆N₂O₈S
• Molecular Weight: 466.51
• CAS Registry Number: 36913-71-0
• SMILES: C2=C1OCC(OC1=C(OC)C=C2)CN4CCC3(SCC(=O)N3)CC4.O=C(O)\C=C\C(=O)O
• InChI: 1S/C17H22N2O4S.C4H4O4/c1-21-13-3-2-4-14-16(13)23-12(10-22-14)9-19-7-5-17(6-8-19)18-15(20)11-24-17;5-3(6)1-2-4(7)8/h2-4,12H,5-11H2,1H3,(H,18,20);1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: IJTMIXAPOHQGLG-WLHGVMLRSA-N

Properties

• Boiling point: 569.2°C at 760 mmHg (Cal.)
• Flash point: 298.1°C (Cal.)