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CS-W001157 4
Total: USD 88.00

2-(4-Methoxy-3-nitrophenyl)acetonitrile

  • CAS No. 56245-07-9

  • Cat. No. CS-0465844
  • Molecule weight192.17
  • Purity≥98%
  • MDL No.MFCD11118823

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

2-(4-Methoxy-3-nitrophenyl)acetonitrile|CS-0465844

Structure of 56245-07-9

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General Information

  • CAS No. 56245-07-9
  • Cat. No. CS-0465844
  • Purity ≥98%
  • MDL No. MFCD11118823
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₃
  • Molecular Weight 192.17
  • Synonym(s) (4-Methoxy-3-nitro-phenyl)-acetonitrile
  • SMILES COC1=C(C=C(C=C1)CC#N)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Macchia, B.; Macchia, M.; Manera, C.; Martinotti, E.; Nancetti, S.; et al. European Journal of Medicinal Chemistry, 1995 , vol. 30, # 11 p. 869 - 880
  • Route2
    • null|null
      151-50-8
    • null|null
      6378-19-4
    • ~%
    • 2-(4-Methoxy-3-nitrophenyl)acetonitrile|CS-0465844
      56245-07-9

    References

    • Hromatka Chemische Berichte, 1942 , vol. 75, p. 123,129
  • Route3
    • null|null
      143-33-9
    • null|null
      6378-19-4
    • ~%
    • 2-(4-Methoxy-3-nitrophenyl)acetonitrile|CS-0465844
      56245-07-9

    References

    • Bersch Archiv der Pharmazie (Weinheim, Germany), 1939 , vol. 277, p. 271,281

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

Quality Control

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Computational Chemistry Data

  • TPSA   76.16
  • LogP   1.66948
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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