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CAS 10130-53-7

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Benzenesulfonic acid, 2,2′-[(4,8-diamino-3,7-dibromo-9,10-dihydro-9,10-dioxo-1,5-anthracenediyl)diimino]bis[5-methyl-, sodium salt (1:2)

Description:
Benzenesulfonic acid, 2,2′-[(4,8-diamino-3,7-dibromo-9,10-dihydro-9,10-dioxo-1,5-anthracenediyl)diimino]bis[5-methyl-, sodium salt (1:2), commonly referred to by its CAS number 10130-53-7, is a complex organic compound characterized by its sulfonic acid functional group and a large anthraquinone-derived structure. This compound typically exhibits high solubility in water due to the presence of the sodium salt, which enhances its ionic character. The presence of multiple amino and bromine substituents contributes to its potential reactivity and biological activity, making it of interest in various applications, including dye chemistry and potential pharmaceutical uses. Its structure suggests that it may have significant electronic properties, which could be exploited in materials science or as a dye. Additionally, the compound's stability and reactivity can be influenced by environmental factors such as pH and temperature, which are important considerations in its practical applications. Overall, this compound represents a unique intersection of organic chemistry and materials science.
Formula:C28H22Br2N4O8S2·2Na
InChI:InChI=1S/C28H22Br2N4O8S2.2Na/c1-11-3-5-15(19(7-11)43(37,38)39)33-17-9-13(29)25(31)23-21(17)27(35)24-22(28(23)36)18(10-14(30)26(24)32)34-16-6-4-12(2)8-20(16)44(40,41)42;;/h3-10,33-34H,31-32H2,1-2H3,(H,37,38,39)(H,40,41,42);;
InChI key:InChIKey=YXQIRBJUUCXHBQ-UHFFFAOYSA-N
SMILES:N(C1=C2C(C(=O)C=3C(C2=O)=C(N)C(Br)=CC3NC4=C(S(=O)(=O)O)C=C(C)C=C4)=C(N)C(Br)=C1)C5=C(S(=O)(=O)O)C=C(C)C=C5.[Na]
Synonyms:
  • Benzenesulfonic acid, 2,2′-[(4,8-diamino-3,7-dibromo-9,10-dihydro-9,10-dioxo-1,5-anthracenediyl)diimino]bis[5-methyl-, disodium salt
  • Benzenesulfonic acid, 2,2′-[(4,8-diamino-3,7-dibromo-9,10-dihydro-9,10-dioxo-1,5-anthracenediyl)diimino]bis[5-methyl-, sodium salt (1:2)
  • m-Toluenesulfonic acid, 6,6′-[(4,8-diamino-3,7-dibromo-1,5-anthraquinonylene)diimino]di-, disodium salt
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