Cas no 25805-30-5 (xyron)

xyron structure
xyron structure
Product Name:xyron
CAS No:25805-30-5
MF:C16H18O
MW:226.313524723053
CID:914062
PubChem ID:3082243
Update Time:2025-04-19

xyron Chemical and Physical Properties

Names and Identifiers

    • xyron
    • 2,6-dimethylphenol,styrene
    • SCHEMBL10946635
    • 25805-30-5
    • 2,6-dimethylphenol;styrene
    • DTXSID10180463
    • Inchi: 1S/C8H10O.C8H8/c1-6-4-3-5-7(2)8(6)9;1-2-8-6-4-3-5-7-8/h3-5,9H,1-2H3;2-7H,1H2
    • InChI Key: QTNKAUVVWGYBNU-UHFFFAOYSA-N
    • SMILES: OC1C(C)=CC=CC=1C.C1(C=C)C=CC=CC=1

Computed Properties

  • Exact Mass: 226.135765193g/mol
  • Monoisotopic Mass: 226.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 149
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 20.2?2
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