1189694-49-2
Product Name:
6-CHLORO-4-[(2,2,3,3-D4-CYCLOPROPYLETHYNYL)TRIFLUOROMETHYLHYDROXYMETHYL]-3H-BENZOXAZOL-2-ONE
Formula:
C14H9ClF3NO3
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COMPUTED DESCRIPTORS
Molecular Weight | 335.70 g/mol |
---|---|
XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 2 |
Exact Mass | 335.0474123 g/mol |
Monoisotopic Mass | 335.0474123 g/mol |
Topological Polar Surface Area | 58.6 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 551 |
Isotope Atom Count | 4 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |