TL;DR: Lactic acid, 3,3,3-trifluoro-, methyl ester, dipropyl phosphate (CAS 108698-12-0) is a chemical compound with molecular formula C10H18F3O6P and molecular weight 322.0793 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-dipropoxyphosphoryloxy-3,3,3-trifluoropropanoate
Also Known As: 3,3,3-Trifluorolactic acid methyl ester dipropyl phosphate, Lactic acid, 3,3,3-trifluoro-, methyl ester, dipropyl phosphate, Propanoic acid, 2-((dipropoxyphosphinyl)oxy)-3,3,3-trifluoro-, methyl ester, methyl 2-dipropoxyphosphoryloxy-3,3,3-trifluoropropanoate, METHYL 2-[(DIPROPOXYPHOSPHORYL)OXY]-3,3,3-TRIFLUOROPROPANOATE
| Molecular Formula | C10H18F3O6P |
| Molecular Weight | 322.0793 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 322.0793 Da |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
| SMILES | CCCOP(=O)(OCCC)OC(C(=O)OC)C(F)(F)F |
| InChIKey | ILANCWSCKWMAHB-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lactic acid, 3,3,3-trifluoro-, methyl ester, dipropyl 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, dipropyl phosphate. Following Lipinski's Rule of Five, Lactic acid, 3,3,3-trifluoro-, methyl ester, dipropyl 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, dipropyl phosphate is 108698-12-0.
The molecular formula of Lactic acid, 3,3,3-trifluoro-, methyl ester, dipropyl phosphate is C10H18F3O6P.
The molecular weight of Lactic acid, 3,3,3-trifluoro-, methyl ester, dipropyl phosphate is 322.0793 g/mol.
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