338415-88-6
Product Name:
3-(1,3-BENZODIOXOL-5-YL)-1-(4-CHLORO-3-NITROPHENYL)-2-PROPEN-1-ONE
Formula:
C16H10ClNO5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 331.70 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 331.0247501 g/mol |
| Monoisotopic Mass | 331.0247501 g/mol |
| Topological Polar Surface Area | 81.4 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 491 |
| 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 |