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CS-W001157 4
Total: USD 88.00

1,1'-(1,3-Phenylene)diethanone

  • CAS No. 6781-42-6

  • Cat. No. CS-W017931
  • Purity≥96%
  • MDL No.MFCD00008740

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

1,1'-(1,3-Phenylene)diethanone|CS-W017931

Structure of 6781-42-6

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General Information

  • CAS No. 6781-42-6
  • Cat. No. CS-W017931
  • Purity ≥96%
  • MDL No. MFCD00008740
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₂
  • Molecular Weight None
  • Synonym(s) 1,3-Diacetylbenzene
  • SMILES CC(=O)C1=CC(=CC=C1)C(C)=O

Description

1,3-Diacetylbenzene is an -diketone. It induces neuropathological changes in the rodent central and peripheral nervous systems.1,3-Diacetylbenzene was used in the preparation of polyhydroxylated analogs.

Synthesis

  • Route1

    References

    • Tetrahedron Letters, , vol. 55, # 10 p. 1756 - 1759
  • Route2

    References

    • Tetrahedron Letters, , vol. 55, # 9 p. 1608 - 1612
  • Route3

    References

    • Park, Jungmin; Yeon, Jihee; Lee, Phil Ho; Lee, Kooyeon Tetrahedron Letters, 2013 , vol. 54, # 33 p. 4414 - 4417

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   34.14
  • LogP   2.0918
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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