Sodium 2-[Bis(3,5-Dibromo-4-Hydroxy-o-Tolyl)Hydroxymethyl]Benzenesulphonate
[CAS# 23778-59-8]

Identification

• Name: Sodium 2-[Bis(3,5-Dibromo-4-Hydroxy-o-Tolyl)Hydroxymethyl]Benzenesulphonate
• Synonyms: Sodium 2-[Bis(3,5-Dibromo-4-Hydroxy-2-Methyl-Phenyl)-Hydroxy-Methyl]Benzenesulfonate; Sodium O-(Bis(3,5-Dibromo-4-Hydroxy-O-Tolyl)Hydroxymethyl)Benzenesulphonate
• Molecular Formula: C₂₁H₁₅Br₄NaO₆S
• Molecular Weight: 738.01
• CAS Registry Number: 23778-59-8
• EINECS: 245-875-1
• SMILES: C1=C(Br)C(=C(Br)C(=C1C(O)(C2=C(C(=C(O)C(=C2)Br)Br)C)C3=C([S]([O-])(=O)=O)C=CC=C3)C)O.[Na+]
• InChI: 1S/C21H16Br4O6S.Na/c1-9-12(7-14(22)19(26)17(9)24)21(28,11-5-3-4-6-16(11)32(29,30)31)13-8-15(23)20(27)18(25)10(13)2;/h3-8,26-28H,1-2H3,(H,29,30,31);/q;+1/p-1
• InChIKey: JZPSZYZAQKDLMK-UHFFFAOYSA-M