Cas no 499206-32-5 (4H-Indazol-4-one, 1-(1,1-dimethylethyl)-1,5,6,7-tetrahydro-)

4H-Indazol-4-one, 1-(1,1-dimethylethyl)-1,5,6,7-tetrahydro- structure
499206-32-5 structure
Product Name:4H-Indazol-4-one, 1-(1,1-dimethylethyl)-1,5,6,7-tetrahydro-
CAS No:499206-32-5
MF:C11H16N2O
MW:192.257542610168
CID:1539987
PubChem ID:11816366
Update Time:2025-04-21

4H-Indazol-4-one, 1-(1,1-dimethylethyl)-1,5,6,7-tetrahydro- Chemical and Physical Properties

Names and Identifiers

    • 4H-Indazol-4-one, 1-(1,1-dimethylethyl)-1,5,6,7-tetrahydro-
    • 1-tert-butyl-4,5,6,7-tetrahydro-1H-indazol-4-one
    • EN300-8599348
    • 499206-32-5
    • G55655
    • 1-(tert-Butyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
    • 1-tert-Butyl-1,5,6,7-tetrahydro-4H-indazole-4-one
    • AKOS002666492
    • 1-tert-butyl-6,7-dihydro-5H-indazol-4-one
    • Inchi: 1S/C11H16N2O/c1-11(2,3)13-9-5-4-6-10(14)8(9)7-12-13/h7H,4-6H2,1-3H3
    • InChI Key: VXMCBKOUWMIZAV-UHFFFAOYSA-N
    • SMILES: O=C1CCCC2=C1C=NN2C(C)(C)C

Computed Properties

  • Exact Mass: 192.12638
  • Monoisotopic Mass: 192.126263138g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 244
  • 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: 1.3
  • Topological Polar Surface Area: 34.9?2

Experimental Properties

  • PSA: 34.89

4H-Indazol-4-one, 1-(1,1-dimethylethyl)-1,5,6,7-tetrahydro- Pricemore >>

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