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121582-46-5

121582-46-5 structural image
Product Name: DIMETHYL 3-OXO-2-(2-[2-(TRIFLUOROMETHYL)PHENYL]HYDRAZONO)PENTANEDIOATE
Formula: C14H13F3N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 346.26 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 7
Exact Mass 346.07765601 g/mol
Monoisotopic Mass 346.07765601 g/mol
Topological Polar Surface Area 97.6 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 531
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