Dioctyl phenylphosphonate
TL;DR: Dioctyl phenylphosphonate (CAS 1754-47-8) is a chemical compound with molecular formula C22H39O3P and molecular weight 382.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dioctoxyphosphorylbenzene
Also Known As: Dioctyl phenylphosphonate, dioctoxyphosphorylbenzene, Dioctylphenylphosphonate, DOPP, di-n-Octyl phenylphosphonate
| Molecular Formula | C22H39O3P |
|---|---|
| Molecular Weight | 382.26 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 382.26367 |
| Heavy Atoms | 26 |
| Complexity | 331.0 |
| Vapor Pressure | 0.00000195 [mmHg] |
Chemical Identifiers
| CAS Number | 1754-47-8 |
|---|---|
| SMILES | CCCCCCCCOP(=O)(C1=CC=CC=C1)OCCCCCCCC |
| InChIKey | HAKMAMKAFTZXOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dioctyl phenylphosphonate (CAS 1754-47-8), with molecular formula C22H39O3P and molecular weight 382.26 g/mol. IUPAC: dioctoxyphosphorylbenzene.
Chemical Property Profile of Dioctyl phenylphosphonate
Property Insights of Dioctyl phenylphosphonate
The XLogP value of 7.9 indicates that Dioctyl phenylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Dioctyl phenylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dioctyl phenylphosphonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dioctyl phenylphosphonate?
The CAS number of Dioctyl phenylphosphonate is 1754-47-8.
What is the molecular formula of Dioctyl phenylphosphonate?
The molecular formula of Dioctyl phenylphosphonate is C22H39O3P.
What is the molecular weight of Dioctyl phenylphosphonate?
The molecular weight of Dioctyl phenylphosphonate is 382.26 g/mol.
Where can I buy Dioctyl phenylphosphonate?
You can request a quote for Dioctyl phenylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dioctyl phenylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dioctyl phenylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.