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CS-W001157 4
Total: USD 88.00

N-(2-Chloroethyl)-4-nitrobenzamide

  • CAS No. 51816-15-0

  • Cat. No. CS-0264045
  • Molecule weight228.63
  • Purity≥98%
  • MDL No.None

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

N-(2-Chloroethyl)-4-nitrobenzamide|CS-0264045

Structure of 51816-15-0

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General Information

  • CAS No. 51816-15-0
  • Cat. No. CS-0264045
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉ClN₂O₃
  • Molecular Weight 228.63
  • Synonym(s) N-(2-chloroethyl)-4-nitro-benzamide
  • SMILES O=C(NCCCl)C1=CC=C([N+]([O-])=O)C=C1

Synthesis

  • Route1
    • N-(2-hydroxyethyl)-4-nitrobenzamide|CS-0331437
      6640-65-9
    • ~%
    • N-(2-Chloroethyl)-4-nitrobenzamide|CS-0264045
      51816-15-0

    References

    • Cassebaum,H.; Uhlig,K. Journal fuer Praktische Chemie (Leipzig), 1973 , vol. 315, # 6 p. 1057 - 1066
  • Route2
    • null|null
      99183-81-0
    • ~%
    • N-(2-Chloroethyl)-4-nitrobenzamide|CS-0264045
      51816-15-0

    References

    • Ben-Ishai Journal of the American Chemical Society, 1956 , vol. 78, p. 4962,4964
  • Route3
    • 2-Chloroethanamine hydrochloride Ifosfamide  Impurity|CS-0229451
      870-24-6
    • null|null
      122-04-3
    • ~%
    • N-(2-Chloroethyl)-4-nitrobenzamide|CS-0264045
      51816-15-0

    References

    • Xia, Chizhong; Hao, Junsheng; Tang, Yiqing; Ni, Yanping; Zhou, Peiwen Synthetic Communications, 2002 , vol. 32, # 9 p. 1457 - 1464

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H312-H315-H318-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   72.24
  • LogP   1.5634
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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