Biphenyl-4,4'-dithiol

Product Information

Molecular Formula:
C12H10S2
Molecular Weight:
218.34
Description
Biphenyl-4,4'-dithiol (CAS# 6954-27-4) is a useful research chemical.
Synonyms
4-(4-sulfanylphenyl)benzenethiol
IUPAC Name
4-(4-sulfanylphenyl)benzenethiol
Canonical SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)S)S
InChI
InChI=1S/C12H10S2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,13-14H
InChI Key
VRPKUXAKHIINGG-UHFFFAOYSA-N
Boiling Point
366.4 °C at 760 mmHg
Melting Point
165-174 °C
Purity
> 98.0 % (LC)
Density
1.213 g/cm3
Appearance
White to tan solid, powder, crystals, crystalline powder and/or chunks
Storage
-20 °C
LogP
3.93100

Safety Information

Hazards
H302 - H413
Precautionary Statement
P264, P270, P273, P301+P312, P330, and P501
Signal Word
Warning

Computed Properties

XLogP3
4.6
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
218.02239267 g/mol
Monoisotopic Mass
218.02239267 g/mol
Topological Polar Surface Area
2Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
145
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
CN-113736085-A Photosensitive resin composition for photocuring 3D printing and preparation method and application thereof 2021-09-29
JP-2022038993-A Method for manufacturing surface treatment agent, water-repellent fiber product and water-repellent fiber product 2020-08-27
US-2022056161-A1 Articles comprising crosslinked polymer network comprising thioether crosslinks and process of making and using same 2020-08-21
CN-111875964-A High-temperature-resistant conductive wave-absorbing sealing material 2020-08-16
WO-2022012694-A1 Uv-led curable and yellowing resistant coating composition 2020-07-17
WO-2022009882-A1 Polyisocyanate composition, method for producing polyisocyanate composition, two-component resin raw material, coating material, adhesive agent, and resin 2020-07-10
EP-3926016-A1 Icephobic coating and coated articles 2020-06-19
JP-2022008097-A Icephobic coating and coated articles 2020-06-19
US-2021395560-A1 Icephobic coating and coated articles 2020-06-19
CN-113801406-A Resin composition 2020-06-12

Literatures

PMID Publication Date Title Journal
22117780 2011-11-25 'Soft and rigid' dithiols and Au nanoparticles grafting on plasma-treated polyethyleneterephthalate Nanoscale research letters
21711893 2011-04-28 Polytetrafluorethylene-Au as a substrate for surface-enhanced Raman spectroscopy Nanoscale research letters
16079841 2005-08-04 Measurement of the conductance of single conjugated molecules Nature
12757731 2003-06-12 Helical templating of oligopeptides by cyclodextrin dimers Bioorganic & medicinal chemistry
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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