chempirical

4,4′-Thiodiphenol

C12H10O2SCAS 2664-63-3218.27 g/mol

Open in Covalent MOL file
HOSOH
PhenolSulfide

Properties

Molecular formula
C12H10O2S
Molar mass
218.27 g/mol
Exact mass
218.0402 Da
Melting point
154–156 °C
Boiling point
178–180 °C (at 1.5 Torr)
logP
3.25Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Identifiers

CAS number
2664-63-3
SMILES
Oc1ccc(Sc2ccc(O)cc2)cc1
InChIKey
VWGKEVWFBOUAND-UHFFFAOYSA-N
InChI
InChI=1S/C12H10O2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,13-14H

Weigh it out

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Names and synonyms

17 names · show all
  • 4-(4-Hydroxyphenylthio)phenol
  • NSC 203030
  • Bis(p-hydroxyphenyl)thioether
  • Bisphenol T
  • 4-(4-Hydroxyphenyl)sulfanylphenol
  • 4,4′-Thiodbisphenol
  • Phenol, 4,4′-thiobis-
  • Phenol, 4,4′-thiodi-
  • Phenol, p,p′-thiodi-
  • Phenol, p,p′-thiobis-
  • 4,4′-Thiobis[phenol]
  • p,p′-Dihydroxydiphenyl sulfide
  • Bis(4-hydroxyphenyl) sulfide
  • 4,4′-Dihydroxydiphenyl sulfide
  • Thiobisphenol
  • Bis(p-hydroxyphenyl) sulfide
  • Bisphenol sulfide

Work with 4,4′-Thiodiphenol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Hydroquinone123-31-960 % similar 4-(Methylthio)phenol1073-72-957 % similar 4-[(4,6-Dimethylpyrimidin-2-yl)thio]phenol107718-34-350 % similar 4,4'-Biphenol92-88-650 % similar 6,6′-Dithiobis[2-naphthalenol]6088-51-344 % similar 4-Chlorophenol106-48-943 % similar Tetrakis(4-hydroxyphenyl)ethylene119301-59-643 % similar 4-Aminophenol123-30-843 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Diphenyl sulfone127-63-9

Elsewhere

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