3-[4-[10,11-Dihydro-8-(Methylthio)Dibenzo[b,f]Thiepin-10-Yl]Piperazinyl]Propyl Decanoate
[CAS# 41931-86-6]

Identification

• Name: 3-[4-[10,11-Dihydro-8-(Methylthio)Dibenzo[b,f]Thiepin-10-Yl]Piperazinyl]Propyl Decanoate
• Synonyms: Decanoic Acid 3-[4-[8-(Methylthio)-5,6-Dihydrobenzo[B][1]Benzothiepin-6-Yl]-1-Piperazinyl]Propyl Ester; Capric Acid 3-[4-[8-(Methylthio)-5,6-Dihydrobenzo[B][1]Benzothiepin-6-Yl]Piperazin-1-Yl]Propyl Ester; 3-(4-(10,11-Dihydro-8-(Methylthio)Dibenzo(B,F)Thiepin-10-Yl)Piperazinyl)Propyl Decanoate
• Molecular Formula: C₃₂H₄₆N₂O₂S₂
• Molecular Weight: 554.85
• CAS Registry Number: 41931-86-6
• EINECS: 255-592-5
• SMILES: C1=C(SC)C=CC4=C1C(N2CCN(CCCOC(CCCCCCCCC)=O)CC2)CC3=C(C=CC=C3)S4
• InChI: 1S/C32H46N2O2S2/c1-3-4-5-6-7-8-9-15-32(35)36-23-12-18-33-19-21-34(22-20-33)29-24-26-13-10-11-14-30(26)38-31-17-16-27(37-2)25-28(29)31/h10-11,13-14,16-17,25,29H,3-9,12,15,18-24H2,1-2H3
• InChIKey: SUVSVBSQNAUQJU-UHFFFAOYSA-N

Properties

• Density: 1.157g/cm³ (Cal.)
• Boiling point: 637.516°C at 760 mmHg (Cal.)
• Flash point: 339.358°C (Cal.)