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CS-W001157 4
Total: USD 88.00

5-Chloro-1H-inden-2(3H)-one

  • CAS No. 74444-81-8

  • Cat. No. CS-0043815
  • Molecule weight166.60
  • Purity≥98%
  • MDL No.MFCD09744099

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

5-Chloro-1H-inden-2(3H)-one|CS-0043815

Structure of 74444-81-8

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General Information

  • CAS No. 74444-81-8
  • Cat. No. CS-0043815
  • Purity ≥98%
  • MDL No. MFCD09744099
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇ClO
  • Molecular Weight 166.60
  • Synonym(s) 5-Chloro-indan-2-one
  • SMILES O=C1CC2=C(C=C(Cl)C=C2)C1

Synthesis

  • Route1
    • 1-Chloro-4-(prop-2-yn-1-yl)benzene|CS-0094847
      70090-69-6
    • ~46%
    • In-stock
      5-Chloro-1H-inden-2(3H)-one|CS-0043815
      74444-81-8

    References

    • Henrion, Guilhem; Chavas, Thomas E. J.; Le Goff, Xavier; Gagosz, Fabien Angewandte Chemie - International Edition, 2013 , vol. 52, # 24 p. 6277 - 6282 Angew. Chem., 2013 , vol. 125, # 24 p. 6397 - 6402,6
  • Route2
    • null|null
      74444-80-7
    • ~63%
    • In-stock
      5-Chloro-1H-inden-2(3H)-one|CS-0043815
      74444-81-8

    References

    • Grouiller; Nioche; Barailler; et al. European Journal of Medicinal Chemistry, 1980 , vol. 15, # 2 p. 139 - 146
  • Route3
    • null|null
      4251-65-4
    • ~%
    • In-stock
      5-Chloro-1H-inden-2(3H)-one|CS-0043815
      74444-81-8

    References

    • Angewandte Chemie - International Edition, , vol. 52, # 24 p. 6277 - 6282 Angew. Chem., , vol. 125, # 24 p. 6397 - 6402,6

Safety Information

Download SDS
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

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.0077
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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