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Org198958-2(AH13789-Na)

  • CAS No. 2412953-13-8

  • Cat. No. CS-0914397
  • Molecule weight2041.14
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

Org198958-2(AH13789-Na)|CS-0914397

Structure of 2412953-13-8

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General Information

  • CAS No. 2412953-13-8
  • Cat. No. CS-0914397
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇₂H₁₁₂NaO₄₉S₈
  • Molecular Weight 2041.14
  • Synonym(s) None
  • SMILES C(S(CCC(O)=O)=O)[C@@H]1[C@]2(O[C@]3(O[C@H](CSCCC(O)=O)[C@]([C@H](O)[C@H]3O)(O[C@]4(O[C@H](CSCCC(O)=O)[C@]([C@H](O)[C@H]4O)(O[C@]5(O[C@H](CSCCC(O)=O)[C@]([C@H](O)[C@H]5O)(O[C@]6(O[C@H](CSCCC(O)=O)[C@@](O[C@]7(O[C@H](CSCCC(O)=O)[C@@](O[C@]8(O[C@H](CSCCC(O)=O)[C@@](O[C@]9(O[C@H](CSCCC(O)=O)[C@@](O[C@@](O1)([C@H](O)[C@H]2O)[H])([C@H](O)C9O)[H])[H])([C@H](O)C8O)[H])[H])([C@H](O)[C@H]7O)[H])[H])([C@H](O)[C@H]6O)[H])[H])[H])[H])[H])[H])[H])[H])[H].[Na]

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   786.83
  • LogP   -9.0469
  • H_Acceptors   48
  • H_Donors   24
  • Rotatable_Bonds   40

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