Bis(2-ethylhexyl) phosphate
TL;DR: Bis(2-ethylhexyl) phosphate (CAS 298-07-7) is a chemical compound with molecular formula C16H35O4P and molecular weight 322.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-ethylhexyl) hydrogen phosphate
Also Known As: Bis(2-ethylhexyl) hydrogen phosphate, Hdehp, Dehpa extractant, BIS(2-ETHYLHEXYL) PHOSPHATE, Di(2-ethylhexyl) phosphate
| Molecular Formula | C16H35O4P |
|---|---|
| Molecular Weight | 322.23 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 322.2273 |
| Heavy Atoms | 21 |
| Complexity | 259.0 |
| Melting Point | less than -60.0 °C |
| Boiling Point | 155 °C at 0.015 mm Hg |
| Density | 0.977 at 20.0 °C - Less dense than water; will float |
| Solubility | Soluble in benzene, hexane, and 4-methyl-2-pentanone |
| Flash Point | 196.1 °C |
| Vapor Pressure | 0.00000005 [mmHg] |
| Refractive Index | = 1.4420 at 25 °C |
Chemical Identifiers
| CAS Number | 298-07-7 |
|---|---|
| SMILES | CCCCC(CC)COP(=O)(O)OCC(CC)CCCC |
| InChIKey | SEGLCEQVOFDUPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bis(2-ethylhexyl) phosphate (CAS 298-07-7), with molecular formula C16H35O4P and molecular weight 322.23 g/mol. IUPAC: bis(2-ethylhexyl) hydrogen phosphate.
Chemical Property Profile of Bis(2-ethylhexyl) phosphate
Property Insights of Bis(2-ethylhexyl) phosphate
The XLogP value of 5.2 indicates that Bis(2-ethylhexyl) phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Bis(2-ethylhexyl) phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-ethylhexyl) phosphate has 1 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 Bis(2-ethylhexyl) phosphate?
The CAS number of Bis(2-ethylhexyl) phosphate is 298-07-7.
What is the molecular formula of Bis(2-ethylhexyl) phosphate?
The molecular formula of Bis(2-ethylhexyl) phosphate is C16H35O4P.
What is the molecular weight of Bis(2-ethylhexyl) phosphate?
The molecular weight of Bis(2-ethylhexyl) phosphate is 322.23 g/mol.
Where can I buy Bis(2-ethylhexyl) phosphate?
You can request a quote for Bis(2-ethylhexyl) phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-ethylhexyl) phosphate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-ethylhexyl) phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.