4-Methoxy-6,11-Dihydrodibenzo(b,e)Thiepin-11-Acetic Acid
[CAS# 82407-43-0]

Identification

• Name: 4-Methoxy-6,11-Dihydrodibenzo(b,e)Thiepin-11-Acetic Acid
• Synonyms: 2-(4-Methoxy-6,11-Dihydrobenzo[C][1]Benzothiepin-11-Yl)Ethanoic Acid; 6,11-Dihydro-4-Methoxydibenzo(B,E)Thiepin-11-Acetic Acid; Brn 4523856
• Molecular Formula: C₁₇H₁₆O₃S
• Molecular Weight: 300.37
• CAS Registry Number: 82407-43-0
• SMILES: C3=C2C(C1=CC=CC=C1CSC2=C(OC)C=C3)CC(=O)O
• InChI: 1S/C17H16O3S/c1-20-15-8-4-7-13-14(9-16(18)19)12-6-3-2-5-11(12)10-21-17(13)15/h2-8,14H,9-10H2,1H3,(H,18,19)
• InChIKey: QKPSDEQAFUFFKQ-UHFFFAOYSA-N

Properties

• Density: 1.254g/cm³ (Cal.)
• Boiling point: 478.787°C at 760 mmHg (Cal.)
• Flash point: 243.362°C (Cal.)