TL;DR: (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol (CAS 151766-95-9) is a chemical compound with molecular formula C11H16ClO4P and molecular weight 278.0475 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(S)-(4-chlorophenyl)-diethoxyphosphorylmethanol
Also Known As: (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol, diethyl [(S)-(4-chlorophenyl)(hydroxy)methyl]phosphonate, [(S)-alpha-Hydroxy-4-chlorobenzyl]phosphonic acid diethyl ester, [(alphaS)-alpha-Hydroxy-4-chlorobenzyl]phosphonic acid diethyl ester, Phosphonic acid, ((4-chlorophenyl)hydroxymethyl)-, diethyl ester
| Molecular Formula | C11H16ClO4P |
| Molecular Weight | 278.0475 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 278.0475 Da |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
| SMILES | CCOP(=O)([C@@H](C1=CC=C(C=C1)Cl)O)OCC |
| InChIKey | RIQJHXWKWXDLFM-NSHDSACASA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol. With a topological polar surface area (TPSA) of 55.8 Ų, (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol 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 (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol is 151766-95-9.
The molecular formula of (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol is C11H16ClO4P.
The molecular weight of (S)-(4-chlorophenyl)-diethoxyphosphorylmethanol is 278.0475 g/mol.
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