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CS-W001157 4
Total: USD 88.00

Xanthotoxol

  • CAS No. 2009-24-7

  • Cat. No. CS-8023
  • Purity≥98%
  • MDL No.MFCD00017408

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

Xanthotoxol|CS-8023

Structure of 2009-24-7

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General Information

  • CAS No. 2009-24-7
  • Cat. No. CS-8023
  • Purity ≥98%
  • MDL No. MFCD00017408
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₆O₄
  • Molecular Weight 202.16
  • Synonym(s) 8-Hydroxypsoralen
  • SMILES O=C1OC(C(C=C1)=C2)=C(O)C3=C2C=CO3

Description

Xanthotoxol is a naturally occurring coumarin derivative featuring a prenyl side chain and a hydroxyl group at the 8-position, conferring enhanced solubility and biological activity. This compound exhibits photoreactive properties due to its extended conjugated system, enabling applications in photochemical studies and targeted molecular modification. Its stability under ambient conditions facilitates handling in routine laboratory workflows.

Application

Xanthotoxol serves as a versatile coumarin-based building block for synthetic and medicinal chemistry applications. Its prenylated structure enables straightforward functionalization at the phenolic hydroxyl and isoprenyl side chain, facilitating derivatization via etherification, oxidation, or coupling reactions. The compound exhibits bench stability and compatibility with standard purification techniques, making it suitable for use in multi-step syntheses of natural product analogs and heterocyclic scaffolds relevant to bioactive molecule discovery.

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-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.58
  • LogP   2.2448
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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