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Methyl 4-acetyl-3-nitrobenzoate

  • CAS No. 51885-81-5

  • Cat. No. CS-0160779
  • Molecule weight223.18
  • Purity≥98%
  • MDL No.MFCD30189414

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

Methyl 4-acetyl-3-nitrobenzoate|CS-0160779

Structure of 51885-81-5

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General Information

  • CAS No. 51885-81-5
  • Cat. No. CS-0160779
  • Purity ≥98%
  • MDL No. MFCD30189414
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₅
  • Molecular Weight 223.18
  • Synonym(s) Benzoic acid, 4-acetyl-3-nitro-, methyl ester
  • SMILES O=C(OC)C1=CC=C(C(C)=O)C([N+]([O-])=O)=C1

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   86.51
  • LogP   1.584
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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