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CS-W001157 4
Total: USD 88.00

6-Nitrochroman-4-one

  • CAS No. 68043-53-8

  • Cat. No. CS-W022515
  • Purity≥98%
  • MDL No.MFCD04038185

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

6-Nitrochroman-4-one|CS-W022515

Structure of 68043-53-8

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General Information

  • CAS No. 68043-53-8
  • Cat. No. CS-W022515
  • Purity ≥98%
  • MDL No. MFCD04038185
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₄
  • Molecular Weight 193.16
  • Synonym(s) 6-NITROCHROMANONE
  • SMILES O=C1CCOC2=C1C=C([N+]([O-])=O)C=C2

Synthesis

  • Route1

    References

    • WYETH Patent: WO2005/37830 A1, 2005 ; Location in patent: Page/Page column 18 ; WO 2005/037830 A1
  • Route2

    References

    • US2002/25965 A1, ;
  • Route3
    • In-stock
      4-Chromanone|CS-W007464
      491-37-2
    • ~80%
    • In-stock
      6-Nitrochroman-4-one|CS-W022515
      68043-53-8
    • 8-Nitrochroman-4-one|CS-0480108
      90322-49-9

    References

    • WO2006/104406 A1, ; Page/Page column 148 ;

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+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   1.56
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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