Cas no 61827-85-8 (Benzene,2,4-dimethyl-1-propyl-)

Benzene,2,4-dimethyl-1-propyl- structure
61827-85-8 structure
Product Name:Benzene,2,4-dimethyl-1-propyl-
CAS No:61827-85-8
MF:C11H16
MW:148.244743347168
CID:522434
PubChem ID:520963
Update Time:2025-04-19

Benzene,2,4-dimethyl-1-propyl- Chemical and Physical Properties

Names and Identifiers

    • Benzene,2,4-dimethyl-1-propyl-
    • 2,4-dimethyl-1-propylbenzene
    • Inchi: 1S/C11H16/c1-4-5-11-7-6-9(2)10(3)8-11/h6-8H,4-5H2,1-3H3
    • InChI Key: FZJVYOOQGFZCSY-UHFFFAOYSA-N
    • SMILES: C(CC)C1C=CC(C)=C(C)C=1

Computed Properties

  • Exact Mass: 148.12528
  • Monoisotopic Mass: 148.125200510g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 107
  • 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: 4
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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