TL;DR: DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester (CAS 152819-36-8) is a chemical compound with molecular formula C14H27NO11P2 and molecular weight 447.10593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-dimethoxyphosphorylethyl) (2S)-2-acetamidobutanedioate
Also Known As: Bis(2-(dimethoxyphosphinyl)ethyl) N-acetyl-DL-aspartate, DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester, Bis[2-(dimethoxyphosphoryl)ethyl] N-acetyl-L-aspartate, bis(2-dimethoxyphosphorylethyl) (2S)-2-acetamidobutanedioate
| Molecular Formula | C14H27NO11P2 |
| Molecular Weight | 447.10593 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 16 |
| Exact Mass | 447.10593 Da |
| Heavy Atoms | 28 |
| Complexity | 608.0 |
| SMILES | CC(=O)N[C@@H](CC(=O)OCCP(=O)(OC)OC)C(=O)OCCP(=O)(OC)OC |
| InChIKey | WPVYAYAJXDLJAT-LBPRGKRZSA-N |
The XLogP value of -2.2 indicates that DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 153.0 Ų indicates high polarity, suggesting DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester is 152819-36-8.
The molecular formula of DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester is C14H27NO11P2.
The molecular weight of DL-Aspartic acid, N-acetyl-, bis(2-(dimethoxyphosphinyl)ethyl) ester is 447.10593 g/mol.
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