Cas no 110086-18-5 (4-bromo-3-tert-butyl-1H-pyrazol-5-amine)

4-bromo-3-tert-butyl-1H-pyrazol-5-amine structure
110086-18-5 structure
Product Name:4-bromo-3-tert-butyl-1H-pyrazol-5-amine
CAS No:110086-18-5
MF:C7H12BrN3
MW:218.09428024292
CID:1191002
PubChem ID:72183255
Update Time:2025-04-20

4-bromo-3-tert-butyl-1H-pyrazol-5-amine Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazol-3-amine, 4-bromo-5-(1,1-dimethylethyl)-
    • 4-bromo-3-tert-butyl-1H-pyrazol-5-amine
    • EN300-1243348
    • 110086-18-5
    • AKOS018927802
    • 4-Bromo-5-(tert-butyl)-1H-pyrazol-3-amine
    • Z1397931867
    • Inchi: 1S/C7H12BrN3/c1-7(2,3)5-4(8)6(9)11-10-5/h1-3H3,(H3,9,10,11)
    • InChI Key: GRKPPXBYKINTCX-UHFFFAOYSA-N
    • SMILES: BrC1C(N)=NNC=1C(C)(C)C

Computed Properties

  • Exact Mass: 217.02156
  • Monoisotopic Mass: 217.02146g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 143
  • 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: 2.3
  • Topological Polar Surface Area: 54.7?2

Experimental Properties

  • PSA: 54.7

4-bromo-3-tert-butyl-1H-pyrazol-5-amine Pricemore >>

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Enamine
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Enamine
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Enamine
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110086-18-5 92.0%
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Enamine
EN300-1243348-1000mg
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Enamine
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