Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester
TL;DR: Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester (CAS 76569-03-4) is a chemical compound with molecular formula C16H17Cl2O5P and molecular weight 390.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1,1-dichloroethyl-(2-methoxyphenoxy)phosphoryl]oxy-2-methoxybenzene
Also Known As: Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester, Bis(2-methoxyphenyl) (1,1-dichloroethyl)phosphonate, 1-[1,1-dichloroethyl-(2-methoxyphenoxy)phosphoryl]oxy-2-methoxybenzene
| Molecular Formula | C16H17Cl2O5P |
|---|---|
| Molecular Weight | 390.02 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.01907 |
| Heavy Atoms | 24 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 76569-03-4 |
|---|---|
| SMILES | CC(P(=O)(OC1=CC=CC=C1OC)OC2=CC=CC=C2OC)(Cl)Cl |
| InChIKey | MAGGJEKHDXVAMI-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester (CAS 76569-03-4), with molecular formula C16H17Cl2O5P and molecular weight 390.02 g/mol. IUPAC: 1-[1,1-dichloroethyl-(2-methoxyphenoxy)phosphoryl]oxy-2-methoxybenzene.
Chemical Property Profile of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester
Property Insights of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester
The XLogP value of 4.7 indicates that Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester?
The CAS number of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester is 76569-03-4.
What is the molecular formula of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester?
The molecular formula of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester is C16H17Cl2O5P.
What is the molecular weight of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester?
The molecular weight of Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester is 390.02 g/mol.
Where can I buy Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester?
You can request a quote for Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) 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, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (1,1-dichloroethyl)-, bis(2-methoxyphenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.