Cas no 21433-91-0 (2-methyl-4-phenylfuran)

2-methyl-4-phenylfuran structure
2-methyl-4-phenylfuran structure
Product Name:2-methyl-4-phenylfuran
CAS No:21433-91-0
MF:C11H10O
MW:158.196503162384
CID:864331
PubChem ID:11008190
Update Time:2025-04-19

2-methyl-4-phenylfuran Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-4-phenylfuran
    • Inchi: 1S/C11H10O/c1-9-7-11(8-12-9)10-5-3-2-4-6-10/h2-8H,1H3
    • InChI Key: KUGFDGJVAIMWFN-UHFFFAOYSA-N
    • SMILES: O1C=C(C=C1C)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 158.0732
  • Monoisotopic Mass: 158.073164938g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 138
  • 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
  • Topological Polar Surface Area: 13.1?2

Experimental Properties

  • PSA: 13.14
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