1-(7-nitro-1,2,3,4-tetrahydro-4aH-xanthen-4a-yl)pyrrolidine
Chemical Structure Depiction of
1-(7-nitro-1,2,3,4-tetrahydro-4aH-xanthen-4a-yl)pyrrolidine
1-(7-nitro-1,2,3,4-tetrahydro-4aH-xanthen-4a-yl)pyrrolidine
Compound characteristics
| Compound ID: | 3824-0023 |
| Compound Name: | 1-(7-nitro-1,2,3,4-tetrahydro-4aH-xanthen-4a-yl)pyrrolidine |
| Molecular Weight: | 300.36 |
| Molecular Formula: | C17 H20 N2 O3 |
| Smiles: | C1CCC2(C(C1)=Cc1cc(ccc1O2)[N+]([O-])=O)N1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0376 |
| logD: | 3.8104 |
| logSw: | -4.2483 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.575 |
| InChI Key: | KVFKCSNCZVQICP-KRWDZBQOSA-N |