Cas no 18811-78-4 (1,2-Benzenediol,4,4'-(1-methylethylidene)bis-)

1,2-Benzenediol,4,4'-(1-methylethylidene)bis- structure
18811-78-4 structure
Product Name:1,2-Benzenediol,4,4'-(1-methylethylidene)bis-
CAS No:18811-78-4
MF:C15H16O4
MW:260.285144805908
CID:123190
PubChem ID:13599489
Update Time:2025-04-18

1,2-Benzenediol,4,4'-(1-methylethylidene)bis- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzenediol,4,4'-(1-methylethylidene)bis-
    • 4,4''-ISOPROPYLIDENEDICATECHOL
    • 4-[2-(3,4-dihydroxyphenyl)propan-2-yl]benzene-1,2-diol
    • 4,4'-Propane-2,2-diyldibenzene-1,2-diol
    • DTXSID30544720
    • SCHEMBL1501111
    • 18811-78-4
    • 4-[1-(3,4-dihydroxyphenyl)-1-methyl-ethyl]benzene-1,2-diol
    • 4,4'-(Propane-2,2-diyl)di(benzene-1,2-diol)
    • Inchi: 1S/C15H16O4/c1-15(2,9-3-5-11(16)13(18)7-9)10-4-6-12(17)14(19)8-10/h3-8,16-19H,1-2H3
    • InChI Key: VZHGHOOLQWRHIG-UHFFFAOYSA-N
    • SMILES: OC1=C(C=CC(=C1)C(C)(C)C1C=CC(=C(C=1)O)O)O

Computed Properties

  • Exact Mass: 260.10488
  • Monoisotopic Mass: 260.10485899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 277
  • 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: 3.3
  • Topological Polar Surface Area: 80.9?2

Experimental Properties

  • Density: 1.325
  • Boiling Point: 498.7°C at 760 mmHg
  • Flash Point: 243.3°C
  • Refractive Index: 1.653
  • PSA: 80.92
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