331460-09-4
Product Name:
(6-NITRO-1,3-BENZODIOXOL-5-YL)METHYL 4-METHYLBENZENECARBOXYLATE
Formula:
C16H13NO6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 315.28 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 315.07428713 g/mol |
| Monoisotopic Mass | 315.07428713 g/mol |
| Topological Polar Surface Area | 90.6 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 442 |
| 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 |