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154187-50-5

154187-50-5 structural image
Product Name: 2-METHOXY-4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]BENZOIC ACID, METHYL ESTER
Formula: C11H9F3N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 274.20 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 274.05652664 g/mol
Monoisotopic Mass 274.05652664 g/mol
Topological Polar Surface Area 60.2 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 391
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