339100-24-2
Product Name:
4-(DIMETHYLAMINO)-1,1,1-TRIFLUORO-3-(1-NITRO-2-NAPHTHYL)-3-BUTEN-2-ONE
Formula:
C16H13F3N2O3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 338.28 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 3 |
Exact Mass | 338.08782677 g/mol |
Monoisotopic Mass | 338.08782677 g/mol |
Topological Polar Surface Area | 66.1 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 526 |
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 |