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CS-W001157 4
Total: USD 88.00

1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one

  • CAS No. 61593-17-7

  • Cat. No. CS-0363374
  • Molecule weight196.67
  • Purity95+%
  • MDL No.None

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

1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one|CS-0363374

Structure of 61593-17-7

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General Information

  • CAS No. 61593-17-7
  • Cat. No. CS-0363374
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃ClO
  • Molecular Weight 196.67
  • Synonym(s) o-chloropivalophenone
  • SMILES CC(C)(C)C(=O)C1=CC=CC=C1Cl

Synthesis

  • Route1

    References

    • Korn, Tobias J.; Schade, Matthias A.; Cheemala, Murthy N.; Wirth, Stefan; Guevara, Simon A.; Cahiez, Gerard; Knochel, Paul Synthesis, 2006 , # 21 p. 3547 - 3574
  • Route2
    • null|null
      2259-30-5
    • null|null
      609-65-4
    • ~72%
    • 1-(2-Chlorophenyl)-2,2-dimethylpropan-1-one|CS-0363374
      61593-17-7

    References

    • Cahiez, Gerard; Luart, Denis; Lecomte, Fabien Organic Letters, 2004 , vol. 6, # 24 p. 4395 - 4398
  • Route3

    References

    • Yoshida, Hiroto; Mimura, Yasuhiro; Ohshita, Joji; Kunai, Atsutaka Chemical Communications, 2007 , # 23 p. 2405 - 2407

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.5688
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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