2,4-Thiazolidinedione, 5-[[3-(trifluoromethyl)phenyl]methylene]-


Chemical Name: 2,4-Thiazolidinedione, 5-[[3-(trifluoromethyl)phenyl]methylene]-
CAS Number: 327033-36-3
Product Number: AG00C6HS(AGN-PC-0K47XT)
Synonyms:
MDL No:
Molecular Formula: C11H6F3NO2S
Molecular Weight: 273.2310

Identification/Properties


Computed Properties
Molecular Weight:
273.229g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
273.007g/mol
Monoisotopic Mass:
273.007g/mol
Topological Polar Surface Area:
71.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
406
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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