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77409-56-4

77409-56-4 structural image
Product Name: 3-ETHYL-5-(1-METHYL-PYRIDIN-2-YLIDENE)-4-OXO-2-THIOXO-OXAZOLE
Formula: C11H12N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 236.29 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 236.06194880 g/mol
Monoisotopic Mass 236.06194880 g/mol
Topological Polar Surface Area 64.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 437
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