4,4'-(4,5,6,7-Tetrabromo-3H-2,1-Benzoxathiol-3-Ylidene)Bis[2,6-Dichlorophenol] S,S-Dioxide
[CAS# 61053-97-2]

Identification

• Name: 4,4'-(4,5,6,7-Tetrabromo-3H-2,1-Benzoxathiol-3-Ylidene)Bis[2,6-Dichlorophenol] S,S-Dioxide
• Synonyms: 2,6-Dichloro-4-[4,5,6,7-Tetrabromo-3-(3,5-Dichloro-4-Hydroxy-Phenyl)-1,1-Dioxo-Benzo[C]Oxathiol-3-Yl]Phenol; 2,6-Dichloro-4-[4,5,6,7-Tetrabromo-3-(3,5-Dichloro-4-Hydroxyphenyl)-1,1-Dioxo-3-Benzo[C]Oxathiolyl]Phenol; 2,6-Dichloro-4-[4,5,6,7-Tetrabromo-3-(3,5-Dichloro-4-Hydroxy-Phenyl)-1,1-Diketo-Benzo[C]Oxathiol-3-Yl]Phenol
• Molecular Formula: C₁₉H₆Br₄Cl₄O₅S
• Molecular Weight: 807.74
• CAS Registry Number: 61053-97-2
• EINECS: 262-578-2
• SMILES: C4=C(C1(O[S](=O)(=O)C2=C(Br)C(=C(Br)C(=C12)Br)Br)C3=CC(=C(O)C(=C3)Cl)Cl)C=C(Cl)C(=C4Cl)O
• InChI: 1S/C19H6Br4Cl4O5S/c20-12-11-18(15(23)14(22)13(12)21)33(30,31)32-19(11,5-1-7(24)16(28)8(25)2-5)6-3-9(26)17(29)10(27)4-6/h1-4,28-29H
• InChIKey: MJVQTNLSJHMBJI-UHFFFAOYSA-N

Properties

• Density: 2.292g/cm³ (Cal.)
• Boiling point: 727.161°C at 760 mmHg (Cal.)
• Flash point: 393.573°C (Cal.)