Cas no 138591-47-6 (2,2',5-Trimethoxy-5'-(prop-2-en-1-yl)-1,1'-biphenyl)

2,2',5-Trimethoxy-5'-(prop-2-en-1-yl)-1,1'-biphenyl structure
138591-47-6 structure
Product Name:2,2',5-Trimethoxy-5'-(prop-2-en-1-yl)-1,1'-biphenyl
CAS No:138591-47-6
MF:C18H20O3
MW:284.349605560303
CID:2773230
PubChem ID:15714559
Update Time:2025-04-21

2,2',5-Trimethoxy-5'-(prop-2-en-1-yl)-1,1'-biphenyl Chemical and Physical Properties

Names and Identifiers

    • DTXSID00577262
    • 2,2',5-Trimethoxy-5'-(prop-2-en-1-yl)-1,1'-biphenyl
    • 138591-47-6
    • Inchi: 1S/C18H20O3/c1-5-6-13-7-9-17(20-3)15(11-13)16-12-14(19-2)8-10-18(16)21-4/h5,7-12H,1,6H2,2-4H3
    • InChI Key: GVPZNFLBLJQCGB-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(CC=C)=CC=1C1C=C(C=CC=1OC)OC

Computed Properties

  • Exact Mass: 284.14124450Da
  • Monoisotopic Mass: 284.14124450Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 6
  • Complexity: 318
  • 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: 4.5
  • Topological Polar Surface Area: 27.7?2
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