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23517-60-4 | 4-Thiazolidinone, 3-(4-chloro-3-methylphenyl)-5-methyl-2-thioxo-
CAS No: 23517-60-4 Catalog No: AG002NJM MDL No:
Product Description
Catalog Number:
AG002NJM
Chemical Name:
4-Thiazolidinone, 3-(4-chloro-3-methylphenyl)-5-methyl-2-thioxo-
CAS Number:
23517-60-4
Molecular Formula:
C11H10ClNOS2
Molecular Weight:
271.7862
IUPAC Name:
3-(4-chloro-3-methylphenyl)-5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C11H10ClNOS2/c1-6-5-8(3-4-9(6)12)13-10(14)7(2)16-11(13)15/h3-5,7H,1-2H3
InChI Key:
SAVQHBALQGLAPW-UHFFFAOYSA-N
SMILES:
S=C1SC(C(=O)N1c1ccc(c(c1)C)Cl)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.989g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.777g/mol
Monoisotopic Mass:
270.989g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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