Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester
TL;DR: Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester (CAS 4115-64-4) is a chemical compound with molecular formula C11H15O3P and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[ethoxy(phenyl)phosphoryl]propanal
Also Known As: (2-Formylethyl)phenylphosphinic acid ethyl ester, 3-[ethoxy(phenyl)phosphoryl]propanal, Ethyl (2-formylethyl)phenylphosphinate, Ethylphenyl(2-formylethyl)phosphinate, ethyl (3-oxopropyl)(phenyl)phosphinate
| Molecular Formula | C11H15O3P |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 226.07588 |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 4115-64-4 |
|---|---|
| SMILES | CCOP(=O)(CCC=O)C1=CC=CC=C1 |
| InChIKey | NULHWQZPYWXJLF-UHFFFAOYSA-N |
Product Overview
Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester (CAS 4115-64-4), with molecular formula C11H15O3P and molecular weight 226.08 g/mol. IUPAC: 3-[ethoxy(phenyl)phosphoryl]propanal.
Chemical Property Profile of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester
Property Insights of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester. With a topological polar surface area (TPSA) of 43.4 Ų, Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester has 0 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 Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester?
The CAS number of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester is 4115-64-4.
What is the molecular formula of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester?
The molecular formula of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester is C11H15O3P.
What is the molecular weight of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester?
The molecular weight of Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester is 226.08 g/mol.
Where can I buy Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester?
You can request a quote for Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphinic acid, (3-oxopropyl)phenyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.