Bis(4-hydroxyphenyl)sulfide

Product Information

Molecular Formula:
C12H10O2S
Molecular Weight:
218.26?
Description
Applications: 4,4'-Thiodiphenol is a useful research chemical.
Synonyms
4-(4-hydroxyphenyl)sulfanylphenol
IUPAC Name
4-(4-hydroxyphenyl)sulfanylphenol
Canonical SMILES
C1=CC(=CC=C1O)SC2=CC=C(C=C2)O
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
InChI Key
VWGKEVWFBOUAND-UHFFFAOYSA-N
Boiling Point
452.7 °C at 760 mmHg
Melting Point
152 °C
Purity
> 98.0 % (GC)
Density
1.37 g/cm3
Appearance
White to light yellow powder to crystaline
LogP
3.24900
Vapor Pressure
0.00000018 [mmHg]

Safety Information

Hazards
H315:
Causes skin irritation.
H318:
Causes serious eye damage.
Precautionary Statement
P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P337+P313, P363, P405, and P501
Signal Word
Danger

Computed Properties

XLogP3
3.3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
218.04015073 g/mol
Monoisotopic Mass
218.04015073 g/mol
Topological Polar Surface Area
65.8Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
162
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
JP-2022043346-A Thermal discoloration writing tool 2022-01-14
CN-114031837-A Crosslinkable polyethylene insulating material for high-voltage cable, preparation method and application thereof 2021-12-20
CN-114015139-A Environment-friendly high-flame-retardant HDPE composite material 2021-12-01
JP-2022022263-A Polyurethane urea water dispersion and matte paint 2021-11-24
CN-113831518-A Method for modifying PBAT (poly (butylene adipate-co-terephthalate)) by using small-molecular phenol 2021-11-15
CN-113863019-A Anti-aging PVC tarpaulin and preparation process thereof 2021-11-15
CN-113999711-A Boronized rare earth hydraulic transmission oil complexing agent and preparation method and application thereof 2021-11-09
CN-114044964-A High-humidity-heat-aging-resistance pe film for solar cell panel and preparation method thereof 2021-11-03
CN-114058026-A Thermoplastic filament containing enzyme modified lignin and preparation method and application thereof 2021-10-19
CN-113637153-A Multi-block polyether type high-molecular surfactant and preparation method and application thereof 2021-10-18

Literatures

PMID Publication Date Title Journal
31836225 2020-05-15 A tiered high-throughput screening approach for evaluation of estrogen and androgen receptor modulation by environmentally relevant bisphenol A substitutes The Science of the total environment
27880919 2017-02-01 Activation of G protein-coupled receptor 30 by thiodiphenol promotes proliferation of estrogen receptor α-positive breast cancer cells Chemosphere
26916392 2017-01-01 In vitro profiling of toxicity and endocrine disrupting effects of bisphenol analogues by employing MCF-7 cells and two-hybrid yeast bioassay Environmental toxicology
21138250 2010-12-01 Influence of the polymer backbone structure on the properties of aromatic ionomers with pendant sulfobenzoyl side chains for use as proton-exchange membranes ACS applied materials & interfaces
19887514 2010-01-01 Monocyclic aromatic amines as potential human carcinogens: old is new again Carcinogenesis
21706621 2009-03-19 Fabrication of compositional-gradient biodegradable polymeric films showing self-bending deformation Macromolecular rapid communications
16497524 2006-11-01 Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods Journal of molecular graphics & modelling
12765246 2003-04-30 Comparison of the reporter gene assay for ER-alpha antagonists with the immature rat uterotrophic assay of 10 chemicals Toxicology letters
12504345 2003-02-01 Immature rat uterotrophic assay of 18 chemicals and Hershberger assay of 30 chemicals Toxicology
11847978 2002-02-01 Acute toxicity, mutagenicity, and estrogenicity of bisphenol-A and other bisphenols Environmental toxicology
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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