Cas no 4506-36-9 (1,4,5-trimethyl-5,6-dihydronaphthalene)

1,4,5-trimethyl-5,6-dihydronaphthalene structure
4506-36-9 structure
Product Name:1,4,5-trimethyl-5,6-dihydronaphthalene
CAS No:4506-36-9
MF:C13H16
MW:172.266143798828
CID:929788
PubChem ID:20595
Update Time:2025-04-19

1,4,5-trimethyl-5,6-dihydronaphthalene Chemical and Physical Properties

Names and Identifiers

    • 1,4,5-trimethyl-5,6-dihydronaphthalene
    • 1,2-Dihydro-1,5,8-trimethylnaphthalene
    • 1,5,8-trimethyl-1,2-dihydronaphthalene
    • YJFOZRTWRVNHOG-UHFFFAOYSA-N
    • 4506-36-9
    • Naphthalene, 1,2-dihydro-1,5,8-trimethyl-
    • UNII-Y6D44B0088
    • 1,5,8-Trimethyl-1,2-dihydronaphthalene #
    • Y6D44B0088
    • Inchi: 1S/C13H16/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h4,6-8,10H,5H2,1-3H3
    • InChI Key: YJFOZRTWRVNHOG-UHFFFAOYSA-N
    • SMILES: C1(C)CC=CC2C(C)=CC=C(C)C1=2

Computed Properties

  • Exact Mass: 172.12528
  • Monoisotopic Mass: 172.125200510g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 204
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 4.1
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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