TL;DR: 1-Dichlorophosphoryloxynaphthalene (CAS 63413-51-4) is a chemical compound with molecular formula C10H7Cl2O2P and molecular weight 259.9561 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-dichlorophosphoryloxynaphthalene
Also Known As: 1-dichlorophosphoryloxynaphthalene, Dichlorophosphonic acid-[1]naphthyl ester, naphthylphosphorodichloridate, 1-Naphthyl dichlorophosphate, naphthyl phosphorodichloridate
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H7Cl2O2P |
| Molecular Weight | 259.9561 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.9561 Da |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2OP(=O)(Cl)Cl |
| InChIKey | BLAOQYUKUBIXCF-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 1-Dichlorophosphoryloxynaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Dichlorophosphoryloxynaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Dichlorophosphoryloxynaphthalene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Dichlorophosphoryloxynaphthalene is 63413-51-4.
The molecular formula of 1-Dichlorophosphoryloxynaphthalene is C10H7Cl2O2P.
The molecular weight of 1-Dichlorophosphoryloxynaphthalene is 259.9561 g/mol.
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