Cas no 62692-63-1 (3-Hexanone, 2-bromo-4,4-diethyl-2-methyl-)

3-Hexanone, 2-bromo-4,4-diethyl-2-methyl- structure
62692-63-1 structure
Product Name:3-Hexanone, 2-bromo-4,4-diethyl-2-methyl-
CAS No:62692-63-1
MF:C11H21BrO
MW:249.187843084335
CID:434946
PubChem ID:71383749
Update Time:2025-04-19

3-Hexanone, 2-bromo-4,4-diethyl-2-methyl- Chemical and Physical Properties

Names and Identifiers

    • 3-Hexanone, 2-bromo-4,4-diethyl-2-methyl-
    • 2-bromo-4,4-diethyl-2-methylhexan-3-one
    • 62692-63-1
    • DTXSID20806046
    • Inchi： 1S/C11H21BrO/c1-6-11(7-2,8-3)9(13)10(4,5)12/h6-8H2,1-5H3
    • InChI Key： SJQHMTAEIPCEDC-UHFFFAOYSA-N
    • SMILES： BrC(C)(C)C(C(CC)(CC)CC)=O

Computed Properties

  • Exact Mass: 248.07763
  • Monoisotopic Mass: 248.07758g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 172
  • 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: 3.8
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07

3-Hexanone, 2-bromo-4,4-diethyl-2-methyl- Related Literature

62692-63-1 (3-Hexanone, 2-bromo-4,4-diethyl-2-methyl-) Related Products

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