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331245-88-6

331245-88-6 structural image
Product Name: TRANS-3,4,5-TRIFLUOROCINNAMIC ACID
Formula: C9H5F3O2
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COMPUTED DESCRIPTORS

Molecular Weight 202.13 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 202.02416388 g/mol
Monoisotopic Mass 202.02416388 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 230
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

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