9-{[4-(heptyloxy)phenyl]methylidene}-2,4,7-trinitro-9H-fluorene
Chemical Structure Depiction of
9-{[4-(heptyloxy)phenyl]methylidene}-2,4,7-trinitro-9H-fluorene
9-{[4-(heptyloxy)phenyl]methylidene}-2,4,7-trinitro-9H-fluorene
Compound characteristics
| Compound ID: | 8001-0636 |
| Compound Name: | 9-{[4-(heptyloxy)phenyl]methylidene}-2,4,7-trinitro-9H-fluorene |
| Molecular Weight: | 503.51 |
| Molecular Formula: | C27 H25 N3 O7 |
| Smiles: | CCCCCCCOc1ccc(\C=C2/c3cc(ccc3c3c2cc(cc3[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.9487 |
| logD: | 7.9487 |
| logSw: | -6.0358 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 107.243 |
| InChI Key: | MYLBHIZXNHLFGB-UHFFFAOYSA-N |