TL;DR: 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate) (CAS 20297-05-6) is a chemical compound with molecular formula C40H83O12P and molecular weight 786.5622 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethyl] hydrogen phosphate
Also Known As: 3,6,9,12-Tetraoxatetracosan-1-ol, hydrogen phosphate, bis[3,6,9,12-Tetraoxatetracosyl] hydrogen phosphate, Bis(3,6,9,12-tetraoxatetracosyl) hydrogen phosphate, di-3,6,9,12-tetraoxatetracos-1-yl hydrogen phosphate, 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate)
| Molecular Formula | C40H83O12P |
| Molecular Weight | 786.5622 g/mol |
| XLogP | 9.0 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 48 |
| Exact Mass | 786.5622 Da |
| Heavy Atoms | 53 |
| Complexity | 667.0 |
| SMILES | CCCCCCCCCCCCOCCOCCOCCOCCOP(=O)(O)OCCOCCOCCOCCOCCCCCCCCCCCC |
| InChIKey | NRPWCKZJQUDHFY-UHFFFAOYSA-N |
The XLogP value of 9.0 indicates that 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate). Following Lipinski's Rule of Five, 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate) has 1 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate) is 20297-05-6.
The molecular formula of 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate) is C40H83O12P.
The molecular weight of 3,6,9,12-Tetraoxatetracosan-1-ol, 1,1'-(hydrogen phosphate) is 786.5622 g/mol.
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