Cas no 153587-06-5 ([3,4-bis(difluoromethoxy)phenyl]methanol)

[3,4-bis(difluoromethoxy)phenyl]methanol structure
153587-06-5 structure
Product Name:[3,4-bis(difluoromethoxy)phenyl]methanol
CAS No:153587-06-5
MF:C9H8F4O3
MW:240.151637077332
CID:1327591
PubChem ID:53484633
Update Time:2025-04-20

[3,4-bis(difluoromethoxy)phenyl]methanol Chemical and Physical Properties

Names and Identifiers

    • [3,4-bis(difluoromethoxy)phenyl]methanol
    • DTXSID60704113
    • (3,4-Bis(difluoromethoxy)phenyl)methanol
    • SCHEMBL7418541
    • 3,4-Bisdifluoromethoxybenzyl alcohol
    • CS-0378485
    • 153587-06-5
    • AKOS015969134
    • Inchi: 1S/C9H8F4O3/c10-8(11)15-6-2-1-5(4-14)3-7(6)16-9(12)13/h1-3,8-9,14H,4H2
    • InChI Key: CXMMIPRPYGDANY-UHFFFAOYSA-N
    • SMILES: FC(OC1C=C(CO)C=CC=1OC(F)F)F

Computed Properties

  • Exact Mass: 240.04095676g/mol
  • Monoisotopic Mass: 240.04095676g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 203
  • 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: 2.5
  • Topological Polar Surface Area: 38.7?2
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