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CS-W001157 4
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5-Amino-1H,3H-benzo[de]isochromene-1,3-dione

  • CAS No. 23204-38-8

  • Cat. No. CS-0333529
  • Molecule weight213.19
  • Purity≥95%
  • MDL No.None

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

5-Amino-1H,3H-benzo[de]isochromene-1,3-dione|CS-0333529

Structure of 23204-38-8

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General Information

  • CAS No. 23204-38-8
  • Cat. No. CS-0333529
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₇NO₃
  • Molecular Weight 213.19
  • Synonym(s) 5-Aminobenzo[DE]isochromene-1,3-dione
  • SMILES C1=CC2=CC(=CC3=C2C(=C1)C(=O)OC3=O)N

Synthesis

  • Route1

    References

    • Middleton; Parrick; Clarke; Wardman Journal of Heterocyclic Chemistry, 1986 , vol. 23, # 3 p. 849 - 855
  • Route2

    References

    • Warner-Lambert Company Patent: US6177423 B1, 2001 ;
  • Route3
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    • ~%
    • 5-Amino-1H,3H-benzo[de]isochromene-1,3-dione|CS-0333529
      23204-38-8

    References

    • Li, Shasha; Zhong, Wenhe; Li, Zhongjun; Meng, Xiangbao European Journal of Medicinal Chemistry, 2012 , vol. 47, # 1 p. 546 - 552

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

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Computational Chemistry Data

  • TPSA   69.39
  • LogP   1.7326
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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