64285-06-9
Product Name:
(+/-)-2-ACETYL-9-AZA BICYCLO[4.2.1]NON-2-ENE FUMARATE
Formula:
C10H15NO
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Color/Form | Oil |
|---|---|
| Decomposition | When heated to decomposition it emits toxic fumes of nitrogen oxides. |
| Dissociation Constants | pKa = 9.4 |
| Other Experimental Properties | Unstable under basic conditions |
| Chemical Classes | Anatoxin-a |
COMPUTED DESCRIPTORS
| Molecular Weight | 165.23 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 165.115364102 g/mol |
| Monoisotopic Mass | 165.115364102 g/mol |
| Topological Polar Surface Area | 29.1 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 232 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
1-[(1r,6r)-9-Azabicyclo[4.2.1]non-2-En-2-Yl]ethanone is a natural product found in Dolichospermum circinale, Microcystis aeruginosa, and other organisms with data available.