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155655-99-5 | 2H-Imidazole-2-thione, 1,3-dihydro-1-(4-nitrophenyl)-
CAS No: 155655-99-5 Catalog No: AG019MDL MDL No:MFCD00060484
Product Description
Catalog Number:
AG019MDL
Chemical Name:
2H-Imidazole-2-thione, 1,3-dihydro-1-(4-nitrophenyl)-
CAS Number:
155655-99-5
MDL Number:
MFCD00060484
IUPAC Name:
3-(4-nitrophenyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C9H7N3O2S/c13-12(14)8-3-1-7(2-4-8)11-6-5-10-9(11)15/h1-6H,(H,10,15)
InChI Key:
NAHKZPQOMYCQIE-UHFFFAOYSA-N
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.234g/mol
Monoisotopic Mass:
221.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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