Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester
TL;DR: Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester (CAS 89210-96-8) is a chemical compound with molecular formula C16H26ClO4P and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(6-diethoxyphosphorylhexoxy)benzene
Also Known As: 1-chloro-4-(6-diethoxyphosphorylhexoxy)benzene, Diethyl [6-(4-chlorophenoxy)hexyl]phosphonate, Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester, Phosphonic acid, [6-(4-chlorophenoxy)hexyl]-, diethyl ester
| Molecular Formula | C16H26ClO4P |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 5.5453 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 348.12573 |
| Heavy Atoms | 22 |
| Complexity | 439.96396 |
Chemical Identifiers
| CAS Number | 89210-96-8 |
|---|---|
| SMILES | CCOP(=O)(CCCCCCOC1=CC=C(C=C1)Cl)OCC |
Product Overview
Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester (CAS 89210-96-8), with molecular formula C16H26ClO4P and molecular weight 348.13 g/mol. IUPAC: 1-chloro-4-(6-diethoxyphosphorylhexoxy)benzene.
Chemical Property Profile of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester
Property Insights of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester
The XLogP value of 5.5453 indicates that Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester 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 Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester?
The CAS number of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester is 89210-96-8.
What is the molecular formula of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester?
The molecular formula of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester is C16H26ClO4P.
What is the molecular weight of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester?
The molecular weight of Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester is 348.13 g/mol.
Where can I buy Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester?
You can request a quote for Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (6-(4-chlorophenoxy)hexyl)-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.