8-chloro-7-[2-nitro-4-(trifluoromethyl)phenoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
8-chloro-7-[2-nitro-4-(trifluoromethyl)phenoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
8-chloro-7-[2-nitro-4-(trifluoromethyl)phenoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-7370 |
| Compound Name: | 8-chloro-7-[2-nitro-4-(trifluoromethyl)phenoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 425.75 |
| Molecular Formula: | C19 H11 Cl F3 N O5 |
| Smiles: | C1CC2=C(C1)c1cc(c(cc1OC2=O)Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1439 |
| logD: | 5.1439 |
| logSw: | -5.6181 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.448 |
| InChI Key: | FFPOAUQDROTCJR-UHFFFAOYSA-N |