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120083-60-5

120083-60-5 structural image
Product Name: 2,3-PYRIDINEDICARBOXYLIC ACID, 5-(TRIFLUOROMETHYL)-, DIETHYL ESTER
Formula: C12H12F3NO4
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COMPUTED DESCRIPTORS

Molecular Weight 291.22 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 291.07184235 g/mol
Monoisotopic Mass 291.07184235 g/mol
Topological Polar Surface Area 65.5 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 359
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes