TL;DR: 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- (CAS 1571-20-6) is a chemical compound with molecular formula C20H25Cl4NO2 and molecular weight 451.06393 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5,6,7-tetrachloro-2-dodecylisoindole-1,3-dione
Also Known As: 3,4,5,6-Tetrachloro-N-dodecylphthalimide, N-Dodecyltetrachlorophthalimide, 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl-, 4,5,6,7-tetrachloro-2-dodecylisoindole-1,3-dione, N-Dodecyl-3,4,5,6-tetrachlorophthalimide
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H25Cl4NO2 |
| Molecular Weight | 451.06393 g/mol |
| XLogP | 9.0 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 453.061 Da |
| Heavy Atoms | 27 |
| Complexity | 472.0 |
| SMILES | CCCCCCCCCCCCN1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl |
| InChIKey | PVGSRFBCZFJQFT-UHFFFAOYSA-N |
The XLogP value of 9.0 indicates that 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- is 1571-20-6.
The molecular formula of 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- is C20H25Cl4NO2.
The molecular weight of 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrachloro-2-dodecyl- is 451.06393 g/mol.
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