Cas no 1025724-57-5 (Ethyl 5-(3-nitrophenyl)-1h-pyrazole-3-carboxylate)

Ethyl 5-(3-nitrophenyl)-1h-pyrazole-3-carboxylate structure
1025724-57-5 structure
Product Name:Ethyl 5-(3-nitrophenyl)-1h-pyrazole-3-carboxylate
CAS No:1025724-57-5
MF:C12H11N3O4
MW:261.233442544937
MDL:MFCD03787571
CID:1132960
PubChem ID:1480766
Update Time:2025-04-20

Ethyl 5-(3-nitrophenyl)-1h-pyrazole-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 5-(3-nitrophenyl)-1h-pyrazole-3-carboxylate
    • MLS000763853
    • STK359205
    • 1025724-57-5
    • ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate
    • CHEMBL1380660
    • MFCD03787571
    • HMS2709J16
    • G78633
    • SMR000336479
    • 5W-0812
    • AKOS003397726
    • ethyl5-(3-nitrophenyl)-1H-pyrazole-3-carboxylate
    • MDL： MFCD03787571
    • Inchi： 1S/C12H11N3O4/c1-2-19-12(16)11-7-10(13-14-11)8-4-3-5-9(6-8)15(17)18/h3-7H,2H2,1H3,(H,13,14)
    • InChI Key： VIKHZBXGLAOVFS-UHFFFAOYSA-N
    • SMILES： O(CC)C(C1=CC(C2C=CC=C(C=2)[N+](=O)[O-])=NN1)=O

Computed Properties

  • Exact Mass: 261.074956g/mol
  • Monoisotopic Mass: 261.074956g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 344
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 261.23g/mol
  • XLogP3: 2.3
  • Topological Polar Surface Area: 101?2

Ethyl 5-(3-nitrophenyl)-1h-pyrazole-3-carboxylate Pricemore >>

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