Vat Brown 5
[CAS# 4425-36-9]

Identification

• Name: Vat Brown 5
• Synonyms: Disodium [2-(1-Sulfonatooxybenzo[E]Benzothiophen-2-Yl)Benzo[E]Benzothiophen-1-Yl] Sulfate; Disodium [2-(1-Sulfonatooxy-2-Benzo[E]Benzothiophenyl)-1-Benzo[E]Benzothiophenyl] Sulfate; Disodium [2-(1-Sulfatobenzo[E]Benzothiophen-2-Yl)Benzo[E]Benzothiophen-1-Yl] Sulfate
• Molecular Formula: C₂₄H₁₂Na₂O₈S₄
• Molecular Weight: 602.57
• CAS Registry Number: 4425-36-9
• EINECS: 224-601-4
• SMILES: C2=C1SC(=C(O[S]([O-])(=O)=O)C1=C3C(=C2)C=CC=C3)C5=C(O[S]([O-])(=O)=O)C4=C6C(=CC=C4S5)C=CC=C6.[Na+].[Na+]
• InChI: 1S/C24H14O8S4.2Na/c25-35(26,27)31-21-19-15-7-3-1-5-13(15)9-11-17(19)33-23(21)24-22(32-36(28,29)30)20-16-8-4-2-6-14(16)10-12-18(20)34-24;;/h1-12H,(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2
• InChIKey: QEUFEMFUODMTPB-UHFFFAOYSA-L