[1,1'-Biphenyl]-4,4'-dithiol


Chemical Name: [1,1'-Biphenyl]-4,4'-dithiol
CAS Number: 6954-27-4
Product Number: AG005X9G(AGN-PC-0JLT83)
Synonyms:
MDL No:
Molecular Formula: C12H10S2
Molecular Weight: 218.3378

Identification/Properties


Properties
MP:
165-174 °C
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
218.332g/mol
XLogP3:
4.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
218.022g/mol
Monoisotopic Mass:
218.022g/mol
Topological Polar Surface Area:
2A^2
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

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2810
Hazard Statements:
H301+H311+H331-H315-H319
Precautionary Statements:
P501-P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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