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CAS 90458-75-6

:

Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 3,3′-(1,4-phenylenedimethylidyne)bis[7,7-dimethyl-2-oxo-, disodium salt

Description:
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 3,3′-(1,4-phenylenedimethylidyne)bis[7,7-dimethyl-2-oxo-, disodium salt, with CAS number 90458-75-6, is a complex organic compound characterized by its bicyclic structure and sulfonic acid functional group. This compound features a bicyclo[2.2.1]heptane core, which contributes to its unique three-dimensional shape and steric properties. The presence of methanesulfonic acid indicates that it has acidic characteristics, which can influence its solubility and reactivity in various environments. The disodium salt form suggests that it is soluble in water, making it potentially useful in aqueous applications. Additionally, the presence of the 1,4-phenylenedimethylidyne group and the dimethyl-2-oxo substituents may impart specific electronic and steric effects, influencing its behavior in chemical reactions. Overall, this compound's structural complexity and functional groups suggest potential applications in fields such as organic synthesis, pharmaceuticals, or materials science, although specific applications would depend on further research and characterization.
Formula:C28H34O8S2·2Na
InChI:InChI=1S/C28H34O8S2.2Na/c1-25(2)21-9-11-27(25,15-37(31,32)33)23(29)19(21)13-17-5-7-18(8-6-17)14-20-22-10-12-28(24(20)30,26(22,3)4)16-38(34,35)36;;/h5-8,13-14,21-22H,9-12,15-16H2,1-4H3,(H,31,32,33)(H,34,35,36);;
InChI key:InChIKey=PMTPPJRGVOWEAV-UHFFFAOYSA-N
SMILES:C(S(=O)(=O)O)C12C(C)(C)C(C(=CC3=CC=C(C=C4C5C(C)(C)C(CS(=O)(=O)O)(C4=O)CC5)C=C3)C1=O)CC2.[Na]
Synonyms:
  • Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 3,3′-(1,4-phenylenedimethylidyne)bis[7,7-dimethyl-2-oxo-, disodium salt
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