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CS-W001157 4
Total: USD 88.00

Methyl 3-nitro-1-naphthoate

  • CAS No. 13772-63-9

  • Cat. No. CS-0150853
  • Molecule weight231.20
  • Purity≥97%
  • MDL No.MFCD00085480

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

Methyl 3-nitro-1-naphthoate|CS-0150853

Structure of 13772-63-9

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General Information

  • CAS No. 13772-63-9
  • Cat. No. CS-0150853
  • Purity ≥97%
  • MDL No. MFCD00085480
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₉NO₄
  • Molecular Weight 231.20
  • Synonym(s) None
  • SMILES COC(=O)C1=C2C=CC=CC2=CC(=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      67-56-1
    • 3-Nitro-1-naphthoic acid|CS-0163739
      4507-84-0
    • ~%
    • Methyl 3-nitro-1-naphthoate|CS-0150853
      13772-63-9

    References

    • Berger, Richard; Edmondson, Scott; Alexa, Hansen; Zhu, Cheng Patent: US2009/118300 A1, 2009 ; Location in patent: Page/Page column 34-35 ;
  • Route2
    • null|null
      67-56-1
    • null|null
      54978-07-3
    • ~%
    • Methyl 3-nitro-1-naphthoate|CS-0150853
      13772-63-9

    References

    • MERCK and CO., INC. Patent: WO2007/120688 A2, 2007 ; Location in patent: Page/Page column 76-77 ; WO 2007/120688 A2
  • Route3
    • null|null
      186581-53-3
    • 3-Nitro-1-naphthoic acid|CS-0163739
      4507-84-0
    • ~87%
    • Methyl 3-nitro-1-naphthoate|CS-0150853
      13772-63-9

    References

    • Kice, John L.; Lotey, Harvinder Journal of Organic Chemistry, 1989 , vol. 54, # 15 p. 3596 - 3602

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   2.5346
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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