445228-83-1
Product Name:
3-(3-NITRO-[1,2,4]TRIAZOL-1-YL)-ADAMANTANE-1-CARBOXYLIC ACID
Formula:
C13H16N4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 292.29 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 292.11715500 g/mol |
| Monoisotopic Mass | 292.11715500 g/mol |
| Topological Polar Surface Area | 114 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 491 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |