866039-51-2
Product Name:
DIMETHYL 2-[2-NITRO-5-(TRIFLUOROMETHYL)PHENYL]MALONATE
Formula:
C12H10F3NO6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 321.21 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 321.04602153 g/mol |
| Monoisotopic Mass | 321.04602153 g/mol |
| Topological Polar Surface Area | 98.4 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 431 |
| 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 |