Cas no 1431964-36-1 (1-(1,3,5-Trimethylpyrazol-4-yl)ethanamine;hydrochloride)

1-(1,3,5-Trimethylpyrazol-4-yl)ethanamine;hydrochloride structure
1431964-36-1 structure
Product Name:1-(1,3,5-Trimethylpyrazol-4-yl)ethanamine;hydrochloride
CAS No:1431964-36-1
MF:C8H16ClN3
MW:189.685740470886
CID:4700083
Update Time:2023-08-14

1-(1,3,5-Trimethylpyrazol-4-yl)ethanamine;hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1-(1,3,5-Trimethyl-1H-pyrazol-4-yl)ethanamine hydrochloride
    • 1-(1,3,5-Trimethylpyrazol-4-yl)ethanamine;hydrochloride
    • Inchi: 1S/C8H15N3.ClH/c1-5(9)8-6(2)10-11(4)7(8)3;/h5H,9H2,1-4H3;1H
    • InChI Key: GKKGFVGLGQXARJ-UHFFFAOYSA-N
    • SMILES: Cl.N1(C)C(C)=C(C(C)=N1)C(C)N

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 137
  • Topological Polar Surface Area: 43.8
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