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CS-W001157 4
Total: USD 88.00

6-Chloro-2,2-dimethylchroman-4-one

  • CAS No. 80055-85-2

  • Cat. No. CS-0551097
  • Purity≥98%
  • MDL No.None

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

6-Chloro-2,2-dimethylchroman-4-one|CS-0551097

Structure of 80055-85-2

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General Information

  • CAS No. 80055-85-2
  • Cat. No. CS-0551097
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁ClO₂
  • Molecular Weight 210.66
  • Synonym(s) 6-Chloro-2,2-dimethyl-4-chromanone
  • SMILES O=C1CC(C)(C)OC2=C1C=C(Cl)C=C2

Synthesis

  • Route1

    References

    • Sebille, Sophie; De Tullio, Pascal; Becker, Benedicte; Antoine, Marie-Helene; Boverie, Stephane; Pirotte, Bernard; Lebrun, Philippe Journal of Medicinal Chemistry, 2005 , vol. 48, # 2 p. 614 - 621
  • Route2
    • null|null
      115997-68-7
    • ~71%
    • 6-Chloro-2,2-dimethylchroman-4-one|CS-0551097
      80055-85-2

    References

    • Ariamala, G.; Balasubramanian, K. K. Tetrahedron, 1989 , vol. 45, # 1 p. 309 - 318
  • Route3
    • null|null
      117543-32-5
    • ~70%
    • 6-Chloro-2,2-dimethylchroman-4-one|CS-0551097
      80055-85-2

    References

    • Ariamala, G.; Balasubramanian, K. K. Tetrahedron, 1989 , vol. 45, # 1 p. 309 - 318

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.0838
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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