Cas no 1340490-04-1 (3-(5-Chlorothiophen-2-yl)-4-ethyl-1h-pyrazol-5-amine)

3-(5-Chlorothiophen-2-yl)-4-ethyl-1h-pyrazol-5-amine structure
1340490-04-1 structure
Product Name:3-(5-Chlorothiophen-2-yl)-4-ethyl-1h-pyrazol-5-amine
CAS No:1340490-04-1
MF:C9H10ClN3S
MW:227.713798999786
CID:5693050
PubChem ID:62278595
Update Time:2023-10-13

3-(5-Chlorothiophen-2-yl)-4-ethyl-1h-pyrazol-5-amine Chemical and Physical Properties

Names and Identifiers

    • 3-(5-CHLOROTHIOPHEN-2-YL)-4-ETHYL-1H-PYRAZOL-5-AMINE
    • 1340490-04-1
    • EN300-1148899
    • AKOS011562036
    • 1H-Pyrazol-3-amine, 5-(5-chloro-2-thienyl)-4-ethyl-
    • 3-(5-Chlorothiophen-2-yl)-4-ethyl-1h-pyrazol-5-amine
    • Inchi: 1S/C9H10ClN3S/c1-2-5-8(12-13-9(5)11)6-3-4-7(10)14-6/h3-4H,2H2,1H3,(H3,11,12,13)
    • InChI Key: LKDGFIRXYBODMO-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C2=C(C(N)=NN2)CC)S1

Computed Properties

  • Exact Mass: 227.0283962g/mol
  • Monoisotopic Mass: 227.0283962g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 205
  • 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
  • XLogP3: 3
  • Topological Polar Surface Area: 82.9?2

Experimental Properties

  • Density: 1.398±0.06 g/cm3(Predicted)
  • Boiling Point: 466.8±45.0 °C(Predicted)
  • pka: 14.49±0.50(Predicted)

3-(5-Chlorothiophen-2-yl)-4-ethyl-1h-pyrazol-5-amine Pricemore >>

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