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CS-W001157 4
Total: USD 88.00

3-Carboxy-3-(3-((4-(8-chloro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11(6H)-ylidene)piperidin-1-yl)methyl)-5-methylpyridin-1-ium-1-yl)propanoate Rupatadine Impurity

  • CAS No. 1354055-68-7

  • Cat. No. CS-0377213
  • Molecule weight532.03
  • Purity≥98%
  • MDL No.None

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

3-Carboxy-3-(3-((4-(8-chloro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11(6H)-ylidene)piperidin-1-yl)methyl)-5-methylpyridin-1-ium-1-yl)propanoate Rupatadine Impurity|CS-0377213

Structure of 1354055-68-7

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General Information

  • CAS No. 1354055-68-7
  • Cat. No. CS-0377213
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₀H₃₀ClN₃O₄
  • Molecular Weight 532.03
  • Synonym(s) Rupatadine fumarate impurity A [EP]
  • SMILES CC1=CC(CN2CC/C(CC2)=C3C4=CC=C(Cl)C=C4CCC5=CC=CN=C5\3)=C[N+](C(C(O)=O)CC([O-])=O)=C1

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   97.44
  • LogP   3.29312
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   6

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