89795-73-3
Product Name:
Nicotinic acid, 1,2-dihydro-6-methyl-5-nitro-2-oxo- (7CI)
Formula:
C7H6N2O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 198.13 g/mol |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 198.02767130 g/mol |
| Monoisotopic Mass | 198.02767130 g/mol |
| Topological Polar Surface Area | 112 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 387 |
| 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 |