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499766-88-0

499766-88-0 structural image
Product Name: ethyl 2-methyl-4-(trifluoromethyl)-1H-imidazole-5-carboxylate
Formula: C8H9F3N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 222.16 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 222.06161202 g/mol
Monoisotopic Mass 222.06161202 g/mol
Topological Polar Surface Area 55 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 245
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