TL;DR: 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one (CAS 115032-61-6) is a chemical compound with molecular formula C21H19NO3 and molecular weight 333.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[2-(dimethylamino)ethoxy]-9-hydroxybenzo[c]fluoren-7-one
Also Known As: 9-Hydroxybenfluron, 9-Hydroxybenflurone, methyl 4-[(triphenyl-, E5-phosphanylidene)methyl]benzoate, 5-(2-dimethylaminoethyloxy)-9-hydroxybenzo[c]fluoren-7-one
| Molecular Formula | C21H19NO3 |
| Molecular Weight | 333.1365 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.1365 Da |
| Heavy Atoms | 25 |
| Complexity | 494.0 |
| SMILES | CN(C)CCOC1=CC2=C(C3=C(C2=O)C=C(C=C3)O)C4=CC=CC=C41 |
| InChIKey | SAMGZMAPTSFCLX-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one is 115032-61-6.
The molecular formula of 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one is C21H19NO3.
The molecular weight of 5-(2-(Dimethylamino)ethoxy)-9-hydroxy-7H-benzo(c)fluoren-7-one is 333.1365 g/mol.
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