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CS-W001157 4
Total: USD 88.00

3-Methyl-6-nitro-2H-chromen-2-one

  • CAS No. 95532-74-4

  • Cat. No. CS-0335885
  • Purity≥98%
  • MDL No.None

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

3-Methyl-6-nitro-2H-chromen-2-one|CS-0335885

Structure of 95532-74-4

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General Information

  • CAS No. 95532-74-4
  • Cat. No. CS-0335885
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇NO₄
  • Molecular Weight 205.17
  • Synonym(s) 3-METHYL-6-NITROCOUMARIN
  • SMILES CC1=CC2=CC(=CC=C2OC1=O)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      95532-69-7
    • ~48%
    • 3-Methyl-6-nitro-2H-chromen-2-one|CS-0335885
      95532-74-4

    References

    • Sunitha, K.; Balasubramanian, K. K.; Rajagopalan, K. Journal of Organic Chemistry, 1985 , vol. 50, # 9 p. 1530 - 1531

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H290-H302+H312+H332-H314
Precautionary Statements : P234-P260-P261-P264-P270-P271-P280-P301+P330+P331-P302+P352-P304+P340-P330-P362+P364-P363-P390-P405-P406-P501

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Computational Chemistry Data

  • TPSA   73.35
  • LogP   2.00962
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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