TL;DR: 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate (CAS 14163-82-7) is a chemical compound with molecular formula C13H21ClNO3P and molecular weight 305.09476 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-tert-butyl-2-chlorophenoxy)-methoxyphosphoryl]-N-methylmethanamine
Also Known As: 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate, N-[(4-tert-butyl-2-chlorophenoxy)-methoxyphosphoryl]-N-methylmethanamine
| Molecular Formula | C13H21ClNO3P |
| Molecular Weight | 305.09476 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.09476 Da |
| Heavy Atoms | 19 |
| Complexity | 343.0 |
| SMILES | CC(C)(C)C1=CC(=C(C=C1)OP(=O)(N(C)C)OC)Cl |
| InChIKey | DHKSNLDSXLVWFF-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate has 0 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 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate is 14163-82-7.
The molecular formula of 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate is C13H21ClNO3P.
The molecular weight of 4-Tert-butyl-2-chlorophenyl methyl dimethylamidophosphate is 305.09476 g/mol.
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