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CS-W001157 4
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Methyl 5-chloro-2-hydroxy-3-nitrobenzoate

  • CAS No. 5043-79-8

  • Cat. No. CS-0041809
  • Molecule weight231.59
  • Purity≥97%
  • MDL No.MFCD00458678

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

Methyl 5-chloro-2-hydroxy-3-nitrobenzoate|CS-0041809

Structure of 5043-79-8

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General Information

  • CAS No. 5043-79-8
  • Cat. No. CS-0041809
  • Purity ≥97%
  • MDL No. MFCD00458678
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆ClNO₅
  • Molecular Weight 231.59
  • Synonym(s) 5-Chloro-2-Hydroxy-3-Nitrobenzoate
  • SMILES O=C(OC)C1=CC(Cl)=CC([N+]([O-])=O)=C1O

Synthesis

  • Route1

    References

    • Kawakita; Kuroita; Yasumoto; Sano; Inaba; Fukuda; Tahara Chemical and Pharmaceutical Bulletin, 1992 , vol. 40, # 3 p. 624 - 630

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07,GHS09
Signal Word : Danger
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H315-H317-H318-H410
Precautionary Statements : P261-P264-P270-P272-P273-P280-P302+P352-P330-P362+P364-P391-P501

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Computational Chemistry Data

  • TPSA   89.67
  • LogP   1.7404
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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