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CS-W001157 4
Total: USD 88.00

Phenyl 4-nitrobenzoate

  • CAS No. 1429-05-6

  • Cat. No. CS-0337279
  • Purity95+%
  • MDL No.None

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

Phenyl 4-nitrobenzoate|CS-0337279

Structure of 1429-05-6

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General Information

  • CAS No. 1429-05-6
  • Cat. No. CS-0337279
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉NO₄
  • Molecular Weight 243.21
  • Synonym(s) P-NITROBENZOIC ACID PHENYL ESTER
  • SMILES C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      122-04-3
    • null|null
      108-95-2
    • ~92%
    • Phenyl 4-nitrobenzoate|CS-0337279
      1429-05-6

    References

    • Yokozawa, Tsutomu; Ogawa, Miyuki; Sekino, Atsushi; Sugi, Ryuji; Yokoyama, Akihiro Journal of the American Chemical Society, 2002 , vol. 124, # 51 p. 15158 - 15159
  • Route2

    References

    • Zhang, Manli; Zhang, Shouhui; Zhang, Guoying; Chen, Fan; Cheng, Jiang Tetrahedron Letters, 2011 , vol. 52, # 19 p. 2480 - 2483
  • Route3

    References

    • Zhang, Di; Pan, Changduo Catalysis Communications, 2012 , vol. 20, p. 41 - 45

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07,GHS09
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H317-H318-H335-H411
Precautionary Statements : P261-P264-P271-P272-P273-P280-P302+P352-P304+P340-P305+P351+P338-P362+P364-P391-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   2.814
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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