1025318-05-1
Product Name:
3-(4-CHLORO-3-NITROPHENYL)-2-(PHENYLCARBONYL)PROP-2-ENENITRILE
Formula:
C16H9ClN2O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 312.70 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 312.0301698 g/mol |
| Monoisotopic Mass | 312.0301698 g/mol |
| Topological Polar Surface Area | 86.7 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 511 |
| 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 |