3H-1,2-Dithiole-3-thione, 5-(4-methoxyphenyl)-


Chemical Name: 3H-1,2-Dithiole-3-thione, 5-(4-methoxyphenyl)-
CAS Number: 532-11-6
Product Number: AG00I9HU(AGN-PC-0JK65K)
Synonyms:
MDL No:
Molecular Formula: C10H8OS3
Molecular Weight: 240.3649

Identification/Properties


Properties
MP:
111°
BP:
398.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.5080 (estimate)
Computed Properties
Molecular Weight:
240.353g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
239.974g/mol
Monoisotopic Mass:
239.974g/mol
Topological Polar Surface Area:
91.9A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
254
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:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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