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CS-W001157 4
Total: USD 88.00

2-Chloro-9H-thioxanthen-9-one

  • CAS No. 86-39-5

  • Cat. No. CS-W020969
  • Purity≥97%
  • MDL No.MFCD00005067

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

2-Chloro-9H-thioxanthen-9-one|CS-W020969

Structure of 86-39-5

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General Information

  • CAS No. 86-39-5
  • Cat. No. CS-W020969
  • Purity ≥97%
  • MDL No. MFCD00005067
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₇ClOS
  • Molecular Weight 246.71
  • Synonym(s) Thioxanthen-9-one,2-chloro-; 2-Chloro-9H-thioxanthen-9-one
  • SMILES ClC1=CC=C2SC3=C(C(C2=C1)=O)C=CC=C3

Description

.

Application

2-Chloro-9H-thioxanthen-9-one serves as a versatile building block in the synthesis of thioxanthene-based scaffolds, leveraging its electrophilic chlorine and ketone functionality for subsequent functionalization. The molecule exhibits good bench stability and facilitates efficient coupling reactions, enabling access to complex heterocyclic systems relevant to medicinal chemistry and materials science. Its structure supports diverse transformations under standard conditions, offering predictable reactivity and straightforward purification.

Synthesis

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      2-Chloro-9H-thioxanthen-9-one|CS-W020969
      86-39-5

    References

    • US2003/229233 A1, ; Page 4 ;
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      2-Chloro-9H-thioxanthen-9-one|CS-W020969
      86-39-5

    References

    • Kobayashi, Kazuhiro; Komatsu, Toshihide; Nakagawa, Kazuhiro; Hara, Erika; Yuba, Shohei Heterocycles, 2013 , vol. 87, # 12 p. 2577 - 2587
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      83986-08-7
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      2-Chloro-9H-thioxanthen-9-one|CS-W020969
      86-39-5
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      83986-07-6

    References

    • Collection of Czechoslovak Chemical Communications, , vol. 47, # 11 p. 3077 - 3093

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02
Signal Word : Danger
UN#: 1325
Class : 4.1
Packing Group : Ⅲ
Hazard Statements : H228
Precautionary Statements : P210-P240-P241-P280-P370+P378

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   4.0681
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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