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CS-W001157 4
Total: USD 88.00

2-Benzoylcyclohexan-1-one

  • CAS No. 3580-38-9

  • Cat. No. CS-0323363
  • Purity98+%
  • MDL No.None

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

2-Benzoylcyclohexan-1-one|CS-0323363

Structure of 3580-38-9

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General Information

  • CAS No. 3580-38-9
  • Cat. No. CS-0323363
  • Purity 98+%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₄O₂
  • Molecular Weight 202.25
  • Synonym(s) 2-Benzoylcyclohexanone
  • SMILES C1=CC=C(C=C1)C(=O)C2CCCCC2=O

Synthesis

  • Route1
    • null|null
      108-94-1
    • null|null
      98-88-4
    • ~79%
    • 2-Benzoylcyclohexan-1-one|CS-0323363
      3580-38-9

    References

    • Nishimura, Yoshio; Miyake, Yutaka; Amemiya, Ryo; Yamaguchi, Masahiko Organic Letters, 2006 , vol. 8, # 22 p. 5077 - 5080
  • Route2
    • null|null
      93-58-3
    • null|null
      14593-46-5
    • ~76%
    • 2-Benzoylcyclohexan-1-one|CS-0323363
      3580-38-9

    References

    • Crompton Corporation Patent: US6410795 B1, 2002 ;
  • Route3
    • null|null
      93-58-3
    • null|null
      107-98-2
    • ~64%
    • 2-Benzoylcyclohexan-1-one|CS-0323363
      3580-38-9

    References

    • Crompton Corporation Patent: US6410795 B1, 2002 ;

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   2.6286
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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