7659-29-2
Product Name:
3,5-DINITROCATECHOL
Formula:
C6H4N2O6
Synonyms:
3,5-Dinitro-1,2-benzenediol;OR-486
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >30 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 200.11 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 0 |
| Exact Mass | 200.00693585 g/mol |
| Monoisotopic Mass | 200.00693585 g/mol |
| Topological Polar Surface Area | 132 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 246 |
| 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 |