TL;DR: Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate (CAS 108682-50-4) is a chemical compound with molecular formula C6H10F3O6P and molecular weight 266.01672 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-dimethoxyphosphoryloxy-3,3,3-trifluoropropanoate
Also Known As: 3,3,3-Trifluorolactic acid methyl ester dimethyl phosphate, Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate, Propanoic acid, 2-((dimethoxyphosphinyl)oxy)-3,3,3-trifluoro-, methyl ester, methyl 2-dimethoxyphosphoryloxy-3,3,3-trifluoropropanoate, METHYL 2-[(DIMETHOXYPHOSPHORYL)OXY]-3,3,3-TRIFLUOROPROPANOATE
| Molecular Formula | C6H10F3O6P |
| Molecular Weight | 266.01672 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 266.01672 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | COC(=O)C(C(F)(F)F)OP(=O)(OC)OC |
| InChIKey | ACAJSEOGAFXIAY-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate. Following Lipinski's Rule of Five, Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate is 108682-50-4.
The molecular formula of Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate is C6H10F3O6P.
The molecular weight of Lactic acid, 3,3,3-trifluoro-, methyl ester, dimethyl phosphate is 266.01672 g/mol.
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