2(3H)-Benzothiazolethione, 4-methyl-


Chemical Name: 2(3H)-Benzothiazolethione, 4-methyl-
CAS Number: 2268-77-1
Product Number: AG006X11(AGN-PC-0LNAC8)
Synonyms:
MDL No:
Molecular Formula: C8H7NS2
Molecular Weight: 181.2779

Identification/Properties


Properties
MP:
161℃
BP:
308.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
181.271g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
181.002g/mol
Monoisotopic Mass:
181.002g/mol
Topological Polar Surface Area:
69.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
181
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


NMR Spectrum


Other Analytical Data


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