Phosphonic acid, benzyl-, monoethyl ester
TL;DR: Phosphonic acid, benzyl-, monoethyl ester (CAS 18933-98-7) is a chemical compound with molecular formula C9H13O3P and molecular weight 200.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl(ethoxy)phosphinic acid
Also Known As: benzyl(ethoxy)phosphinic acid, Monoethyl benzylphosphonate, ethyl hydrogen benzylphosphonate, Benzyl-ethoxy-phosphinic Acid, benzyl-ethoxyphosphinic acid
| Molecular Formula | C9H13O3P |
|---|---|
| Molecular Weight | 200.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.06023 |
| Heavy Atoms | 13 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 18933-98-7 |
|---|---|
| SMILES | CCOP(=O)(CC1=CC=CC=C1)O |
| InChIKey | WSOJYRTVHMMFST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphonic acid, benzyl-, monoethyl ester (CAS 18933-98-7), with molecular formula C9H13O3P and molecular weight 200.06 g/mol. IUPAC: benzyl(ethoxy)phosphinic acid.
Chemical Property Profile of Phosphonic acid, benzyl-, monoethyl ester
Property Insights of Phosphonic acid, benzyl-, monoethyl ester
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, benzyl-, monoethyl ester. With a topological polar surface area (TPSA) of 46.5 Ų, Phosphonic acid, benzyl-, monoethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, benzyl-, monoethyl ester has 1 hydrogen bond donor(s) and 3 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, benzyl-, monoethyl ester?
The CAS number of Phosphonic acid, benzyl-, monoethyl ester is 18933-98-7.
What is the molecular formula of Phosphonic acid, benzyl-, monoethyl ester?
The molecular formula of Phosphonic acid, benzyl-, monoethyl ester is C9H13O3P.
What is the molecular weight of Phosphonic acid, benzyl-, monoethyl ester?
The molecular weight of Phosphonic acid, benzyl-, monoethyl ester is 200.06 g/mol.
Where can I buy Phosphonic acid, benzyl-, monoethyl ester?
You can request a quote for Phosphonic acid, benzyl-, monoethyl 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, benzyl-, monoethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, benzyl-, monoethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.