二辛基苯基磷酸酯
TL;DR: 二辛基苯基磷酸酯 (CAS 6161-81-5) is a chemical compound with molecular formula C22H39O4P and molecular weight 398.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二辛基苯基磷酸酯
dioctyl phenyl phosphate
Also Known As: Dioctyl phenyl phosphate, Di-n-octyl phenyl phosphate, di-n-Octylphenylphosphate, dioctylphenylphosphoric acid, Phosphoric acid dioctylphenyl ester
| Molecular Formula | C22H39O4P |
|---|---|
| Molecular Weight | 398.26 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 398.2586 |
| Heavy Atoms | 27 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 6161-81-5 |
|---|---|
| SMILES | CCCCCCCCOP(=O)(OCCCCCCCC)OC1=CC=CC=C1 |
| InChIKey | QHGRPTNUHWYCEN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二辛基苯基磷酸酯 (CAS 6161-81-5), with molecular formula C22H39O4P and molecular weight 398.26 g/mol. IUPAC: dioctyl phenyl phosphate.
Chemical Property Profile of 二辛基苯基磷酸酯
Property Insights of 二辛基苯基磷酸酯
The XLogP value of 8.6 indicates that 二辛基苯基磷酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 二辛基苯基磷酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二辛基苯基磷酸酯 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 二辛基苯基磷酸酯?
The CAS number of 二辛基苯基磷酸酯 is 6161-81-5.
What is the molecular formula of 二辛基苯基磷酸酯?
The molecular formula of 二辛基苯基磷酸酯 is C22H39O4P.
What is the molecular weight of 二辛基苯基磷酸酯?
The molecular weight of 二辛基苯基磷酸酯 is 398.26 g/mol.
Where can I buy 二辛基苯基磷酸酯?
You can request a quote for 二辛基苯基磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二辛基苯基磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 二辛基苯基磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.