3-(4-chlorophenyl)-1H-imidazole-2-thione


Chemical Name: 3-(4-chlorophenyl)-1H-imidazole-2-thione
CAS Number: 17452-12-9
Product Number: AG001ZQX(AGN-PC-0JVP3L)
Synonyms:
MDL No:
Molecular Formula: C9H7ClN2S
Molecular Weight: 210.6833

Identification/Properties


Computed Properties
Molecular Weight:
210.679g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
210.002g/mol
Monoisotopic Mass:
210.002g/mol
Topological Polar Surface Area:
47.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
234
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:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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