Cas no 672295-31-7 (1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI))

1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI) structure
672295-31-7 structure
Product Name:1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI)
CAS No:672295-31-7
MF:C13H20O
MW:192.297304153442
CID:965584
Update Time:2024-03-05

1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI) Chemical and Physical Properties

Names and Identifiers

    • 1H-Inden-1-one,2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-(9CI)
    • 1H-Inden-1-one, 2,3,4,5,6,7-hexahydro-3-methyl-3-(1-methylethyl)-
    • Inchi: 1S/C13H20O/c1-9(2)13(3)8-12(14)10-6-4-5-7-11(10)13/h9H,4-8H2,1-3H3
    • InChI Key: BKKUEXONUWBZBJ-UHFFFAOYSA-N
    • SMILES: C1(=O)C2=C(CCCC2)C(C)(C(C)C)C1

Computed Properties

  • Exact Mass: 192.151
  • Monoisotopic Mass: 192.151
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 298
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 17.1A^2
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