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CS-W001157 4
Total: USD 88.00

5-Amino-1H-isochromen-1-one

  • CAS No. 70758-25-7

  • Cat. No. CS-0455095
  • Purity≥98%
  • MDL No.None

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

5-Amino-1H-isochromen-1-one|CS-0455095

Structure of 70758-25-7

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General Information

  • CAS No. 70758-25-7
  • Cat. No. CS-0455095
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₂
  • Molecular Weight 161.16
  • Synonym(s) 5-amino-isochromen-1-one
  • SMILES C1=CC2=C(C=COC2=O)C(=C1)N

Synthesis

  • Route1
    • 5-Nitro-1H-isochromen-1-one|CS-0102755
      77747-69-4
    • ~99%
    • 5-Amino-1H-isochromen-1-one|CS-0455095
      70758-25-7

    References

    • Parveen, Ifat; Naughton, Declan P.; Whish, William J. D.; Threadgill, Michael D. Bioorganic and Medicinal Chemistry Letters, 1999 , vol. 9, # 14 p. 2031 - 2036
  • Route2

    References

    • Somei; Karasawa; Shoda; Kaneko Chemical and Pharmaceutical Bulletin, 1981 , vol. 29, # 1 p. 249 - 253
  • Route3
    • null|null
      77747-70-7
    • ~%
    • 5-Amino-1H-isochromen-1-one|CS-0455095
      70758-25-7

    References

    • Somei; Karasawa; Shoda; Kaneko Chemical and Pharmaceutical Bulletin, 1981 , vol. 29, # 1 p. 249 - 253

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

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Computational Chemistry Data

  • TPSA   56.23
  • LogP   1.3752
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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