Dioctyl dihydrogen diphosphate
TL;DR: Dioctyl dihydrogen diphosphate (CAS 1506-38-3) is a chemical compound with molecular formula C16H36O7P2 and molecular weight 402.19363 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[hydroxy(octoxy)phosphoryl] octyl hydrogen phosphate
Also Known As: Dioctyl dihydrogen diphosphate, Dioctyl pyrophosphate, Octyl pyrophosphate, Dioctyl acid pyrophosphate, Dioctyl diphosphate
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H36O7P2 |
| Molecular Weight | 402.19363 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 18 |
| Exact Mass | 402.19363 Da |
| Heavy Atoms | 25 |
| Complexity | 368.0 |
| SMILES | CCCCCCCCOP(=O)(O)OP(=O)(O)OCCCCCCCC |
| InChIKey | UMHKOAYRTRADAT-UHFFFAOYSA-N |
Chemical Property Profile of Dioctyl dihydrogen diphosphate
Property Insights of Dioctyl dihydrogen diphosphate
The XLogP value of 4.7 indicates that Dioctyl dihydrogen diphosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dioctyl dihydrogen diphosphate. Following Lipinski's Rule of Five, Dioctyl dihydrogen diphosphate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dioctyl dihydrogen diphosphate?
The CAS number of Dioctyl dihydrogen diphosphate is 1506-38-3.
What is the molecular formula of Dioctyl dihydrogen diphosphate?
The molecular formula of Dioctyl dihydrogen diphosphate is C16H36O7P2.
What is the molecular weight of Dioctyl dihydrogen diphosphate?
The molecular weight of Dioctyl dihydrogen diphosphate is 402.19363 g/mol.
Where can I buy Dioctyl dihydrogen diphosphate?
You can request a quote for Dioctyl dihydrogen diphosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dioctyl dihydrogen diphosphate?
Yes, CoreyChem provides custom synthesis services for Dioctyl dihydrogen diphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.