Cas no 552-80-7 (Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis-)

Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis- structure
552-80-7 structure
Product Name:Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis-
CAS No:552-80-7
MF:C16H16O2
MW:240.297044754028
CID:368941
PubChem ID:3004636
Update Time:2025-04-19

Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis- Chemical and Physical Properties

Names and Identifiers

    • Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis-
    • 4,4'-Stilbenediol, trans-.α.,.α.'-dimethyl-
    • DIMETHYLSTILBESTROL
    • 2,3-bis(4-hydroxyphenyl)-2-butene
    • 2,3-Bis-(4-hydroxy-phenyl)-but-2t-en
    • 2,3-bis-(4-hydroxy-phenyl)-but-2t-ene
    • 4,4'-(1,2-Dimethyl-1,2-ethenediyl)bis(phenol) (E)-
    • 4,4'-(1,2-dimethyl-ethene-1,2-diyl)-bis-phenol
    • 4,4'-[(E)-2-Butene-2,3-diyl]bisphenol
    • ALPHAALPHADIMETHYL44STILBENEDIOL
    • Dimethylstilbesterol
    • E-4,4'-[1,2-dimethyl-1,2-ethenediyl]bisphenol
    • Nsc45946
    • trans-2,3-bis(4'-hydroxyphenyl)-2-butene
    • 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
    • 13366-36-4
    • NSC-45946
    • NSC 45946
    • BDBM50410510
    • 4,4'-(2E)-but-2-ene-2,3-diyldiphenol
    • CHEMBL269003
    • AI3-61021
    • 30L22Q8N9M
    • Phenol,4'-(1,2-dimethyl-1,2-ethenediyl)bis-, (E)-
    • NSC-658943
    • 4,4'-Stilbenediol, alpha,alpha'-dimethyl-, (E)-
    • alpha,alpha'-Dimethyl-4,4'-stilbenediol
    • UNII-30L22Q8N9M
    • Dimethylstilboestrol
    • SCHEMBL125634
    • 4,4'-Stilbenediol, .alpha.,.alpha.'-dimethyl-, (E)-
    • dimethylstibestrol
    • 4, .alpha.,.alpha.'-dimethyl-, (E)-
    • Q27116241
    • NSC658943
    • SCHEMBL125635
    • 4,2-dimethyl-1,2-ethenediyl)bis(phenol) (E)-
    • .alpha.,4'-stilbenediol (E)-
    • 4-[(E)-2-(4-hydroxyphenyl)-1-methyl-prop-1-enyl]phenol
    • DTXSID2022468
    • .alpha.,.alpha.'-Dimethyl-4,4'-stilbenediol
    • alpha,alpha'-Dimethyl-4,4'-stilbenediol (E)-
    • 4, trans-.alpha.,.alpha.'-dimethyl-
    • 4,4'-(1,2-Dimethyl-1,2-ethenediyl)diphenol
    • Phenol, 4,4'-(1,2-dimethyl-1,2-ethenediyl)bis-
    • Phenol, 4,4'-((1E)-1,2-dimethyl-1,2-ethenediyl)bis-
    • 552-80-7
    • (E)-4,4'-(1,2-Dimethyl-1,2-ethenediyl)bisphenol
    • 4,4'-Stilbenediol, alpha,alpha'-dimethyl
    • CHEBI:34717
    • BIDD:ER0155
    • Phenol, 4,4'-(1,2-dimethyl-1,2-ethenediyl)bis-, (E)-
    • Inchi： 1S/C16H16O2/c1-11(13-3-7-15(17)8-4-13)12(2)14-5-9-16(18)10-6-14/h3-10,17-18H,1-2H3/b12-11+
    • InChI Key： XPINIPXARSNZDM-VAWYXSNFSA-N
    • SMILES： OC1C=CC(=CC=1)/C(/C)=C(\C)/C1C=CC(=CC=1)O

Computed Properties

  • Exact Mass: 240.11508
  • Monoisotopic Mass: 240.115029749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 262
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.7
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • Density: 1.1228 (rough estimate)
  • Boiling Point: 323.02°C (rough estimate)
  • Refractive Index: 1.4700 (estimate)
  • PSA: 40.46

Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis- Security Information

  • Safety Term：Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.

Phenol,4,4'-[(1E)-1,2-dimethyl-1,2-ethenediyl]bis- Related Literature

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