Cas no 51834-89-0 (Phenol, 3,3'-[1,3-propanediylbis(oxy)]bis-)

Phenol, 3,3'-[1,3-propanediylbis(oxy)]bis- structure
51834-89-0 structure
Product Name:Phenol, 3,3'-[1,3-propanediylbis(oxy)]bis-
CAS No:51834-89-0
MF:C15H16O4
MW:260.285144805908
CID:361274
PubChem ID:12298490
Update Time:2025-04-19

Phenol, 3,3'-[1,3-propanediylbis(oxy)]bis- Chemical and Physical Properties

Names and Identifiers

    • Phenol, 3,3'-[1,3-propanediylbis(oxy)]bis-
    • 3-[3-(3-hydroxyphenoxy)propoxy]phenol
    • 51834-89-0
    • DTXSID70486034
    • SCHEMBL11231915
    • Inchi: 1S/C15H16O4/c16-12-4-1-6-14(10-12)18-8-3-9-19-15-7-2-5-13(17)11-15/h1-2,4-7,10-11,16-17H,3,8-9H2
    • InChI Key: RHVKMIJTNRFDNQ-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=C(C=1)O)CCCOC1C=CC=C(C=1)O

Computed Properties

  • Exact Mass: 260.10488
  • Monoisotopic Mass: 260.10485899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 6
  • Complexity: 222
  • 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: 3.4
  • Topological Polar Surface Area: 58.9?2

Experimental Properties

  • PSA: 58.92
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