8-((2-Methoxy-3-(4-phenylpiperidin-1-yl)propyl)oxy)thiochroman fumarate
[CAS# 153804-60-5]

Identification

• Name: 8-((2-Methoxy-3-(4-phenylpiperidin-1-yl)propyl)oxy)thiochroman fumarate
• Synonyms: But-2-Enedioic Acid; 1-(2-Methoxy-3-Thiochroman-8-Yloxy-Propyl)-4-Phenyl-Piperidine; But-2-Enedioic Acid; 1-[2-Methoxy-3-(8-Thiochromanyloxy)Propyl]-4-Phenylpiperidine; 8-((2-Methoxy-3-(4-Phenylpiperidin-1-Yl)Propyl)Oxy)Thiochroman Fumarate
• Molecular Formula: C₂₈H₃₅NO₆S
• Molecular Weight: 513.65
• CAS Registry Number: 153804-60-5
• SMILES: C1=CC=C4C(=C1OCC(OC)CN3CCC(C2=CC=CC=C2)CC3)SCCC4.O=C(O)\C=C\C(=O)O
• InChI: 1S/C24H31NO2S.C4H4O4/c1-26-22(18-27-23-11-5-9-21-10-6-16-28-24(21)23)17-25-14-12-20(13-15-25)19-7-3-2-4-8-19;5-3(6)1-2-4(7)8/h2-5,7-9,11,20,22H,6,10,12-18H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: NCRPGBKJFZCLLY-WLHGVMLRSA-N

Properties

• Boiling point: 558.2°C at 760 mmHg (Cal.)
• Flash point: 291.4°C (Cal.)