2(1H)-Pyridinethione, 3-bromo-


Chemical Name: 2(1H)-Pyridinethione, 3-bromo-
CAS Number: 65938-86-5
Product Number: AG00FGAD(AGN-PC-0NIUFX)
Synonyms:
MDL No:
Molecular Formula: C5H4BrNS
Molecular Weight: 190.0610

Identification/Properties


Properties
MP:
205-207℃(Solv: ethanol (64-17-5); water (7732-18-5))
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
190.058g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
188.925g/mol
Monoisotopic Mass:
188.925g/mol
Topological Polar Surface Area:
44.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
171
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
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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