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CS-W001157 4
Total: USD 88.00

5,5-Dimethyl-2-(2-oxo-2-phenylethyl)cyclohexane-1,3-dione

  • CAS No. 37456-51-2

  • Cat. No. CS-0332535
  • Purity≥98%
  • MDL No.None

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

5,5-Dimethyl-2-(2-oxo-2-phenylethyl)cyclohexane-1,3-dione|CS-0332535

Structure of 37456-51-2

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General Information

  • CAS No. 37456-51-2
  • Cat. No. CS-0332535
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₈O₃
  • Molecular Weight 258.31
  • Synonym(s) 5,5-DIMETHYL-2-PHENACYL-1,3-CYCLOHEXANEDIONE)
  • SMILES CC1(C)CC(=O)C(CC(=O)C2=CC=CC=C2)C(=O)C1

Synthesis

  • Route1

    References

    • Dagher, C.; Hanna, R.; Terentiev, P. B.; Boundel, Y. G.; Kost, A. N.; Maksimov, B. I. Journal of Heterocyclic Chemistry, 1982 , vol. 19, p. 645 - 647
  • Route2
    • In-stock
      Dimedone|CS-W016456
      126-81-8
    • null|null
      70-11-1
    • ~87%
    • null|null
      58136-91-7
    • 5,5-Dimethyl-2-(2-oxo-2-phenylethyl)cyclohexane-1,3-dione|CS-0332535
      37456-51-2

    References

    • Maini, Prem Nath; Sammes, Michael P.; Katritzky, Alan R. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1988 , p. 161 - 168
  • Route3

    References

    • Gonzalez-Chavez, Rodolfo; Martinez, Roberto; Torre-Bouscoulet, Maria Eugenia; Gallo, Marco; Gonzalez-Chavez, Marco Martin Chemical and Pharmaceutical Bulletin, 2014 , vol. 62, # 1 p. 16 - 24

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

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Computational Chemistry Data

  • TPSA   51.21
  • LogP   2.8338
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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