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CS-W001157 4
Total: USD 88.00

3,4-Dihydro-2h-1,5-benzodioxepine-6-carboxylic acid

  • CAS No. 66410-67-1

  • Cat. No. CS-0243464
  • Molecule weight194.18
  • Purity98+%
  • MDL No.None

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

3,4-Dihydro-2h-1,5-benzodioxepine-6-carboxylic acid|CS-0243464

Structure of 66410-67-1

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General Information

  • CAS No. 66410-67-1
  • Cat. No. CS-0243464
  • Purity 98+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₄
  • Molecular Weight 194.18
  • Synonym(s) 3,4-dihydro-2H-benzo-1,5-dioxepin-6-carboxylic acid
  • SMILES C1=CC(=C2C(=C1)OCCCO2)C(=O)O

Synthesis

  • Route1
    • null|null
      66410-66-0
    • ~93%
    • 3,4-Dihydro-2h-1,5-benzodioxepine-6-carboxylic acid|CS-0243464
      66410-67-1

    References

    • Takeda Chemical Industries, Ltd. Patent: EP1362846 A1, 2003 ; Location in patent: Page/Page column 86 ; EP 1362846 A1

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

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Computational Chemistry Data

  • TPSA   55.76
  • LogP   1.5461
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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