Home Halogens 1-(4-chlorophenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one

1-(4-chlorophenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one

CAS No.:
55327-43-0
Catalog Number:
AG01EIT2
Molecular Formula:
C9H7ClN2OS
Molecular Weight:
226.6827
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Product Description
Catalog Number:
AG01EIT2
Chemical Name:
1-(4-chlorophenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one
CAS Number:
55327-43-0
Molecular Formula:
C9H7ClN2OS
Molecular Weight:
226.6827
MDL Number:
MFCD00975548
IUPAC Name:
3-(4-chlorophenyl)-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C9H7ClN2OS/c10-6-1-3-7(4-2-6)12-8(13)5-11-9(12)14/h1-4H,5H2,(H,11,14)
InChI Key:
GIKZSOCWOZJBCD-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)N1C(=NCC1=O)S
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.997g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.678g/mol
Monoisotopic Mass:
225.997g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties