Cas no 181867-24-3 (Ethyl 3-Phenylpyrazole-4-carboxylate)

Ethyl 3-Phenylpyrazole-4-carboxylate structure
181867-24-3 structure
Product Name:Ethyl 3-Phenylpyrazole-4-carboxylate
CAS No:181867-24-3
MF:C12H12N2O2
MW:216.235882759094
CID:113732
PubChem ID:271436
Update Time:2025-04-18

Ethyl 3-Phenylpyrazole-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole-4-carboxylicacid, 3-phenyl-, ethyl ester
    • Ethyl 5-phenyl-1H-pyrazole-4-carboxylate
    • ETHYL-3-PHENYL PYRAZOLE-4-CARBOXYLATE
    • 3-phenyl-4-ethoxycarbonylpyrazole
    • BUTTPARK 146 4-15
    • ethyl 3-phenyl-1H-pyrazole-4-carboxylate
    • RARECHEM AL BI 0428
    • BUTTPARK 146\04-15
    • Ethyl-3-Phenyl Pyrazole-4-Carboxylate(WX618318)
    • SCHEMBL2921221
    • NSC115005
    • 4-ethoxycarbonyl-3-phenylpyrazole
    • 1H-Pyrazole-4-carboxylic acid, 3-phenyl-, ethyl ester
    • MFCD00228627
    • 181867-24-3
    • SY125985
    • AS-69348
    • ETHYL-3-PHENYLPYRAZOLE-4-CARBOXYLATE
    • W10274
    • SCHEMBL11890411
    • AC-30776
    • NSC-115005
    • ethyl 3-phenylpyrazole-4-carboxylate
    • AKOS024015294
    • CS-0037368
    • DTXSID801214052
    • LQIYWOVORITWEA-UHFFFAOYSA-N
    • Ethyl 3-Phenylpyrazole-4-carboxylate
    • MDL: MFCD00228627
    • Inchi: 1S/C12H12N2O2/c1-2-16-12(15)10-8-13-14-11(10)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,13,14)
    • InChI Key: LQIYWOVORITWEA-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1C=NNC=1C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 216.09000
  • Monoisotopic Mass: 216.09
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 239
  • 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
  • Topological Polar Surface Area: 55A^2
  • XLogP3: 2.1

Experimental Properties

  • Density: 1.196
  • Boiling Point: 427°Cat760mmHg
  • Flash Point: 212°C
  • Refractive Index: 1.575
  • PSA: 54.98000
  • LogP: 2.25340

Ethyl 3-Phenylpyrazole-4-carboxylate Pricemore >>

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