Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester
TL;DR: Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester (CAS 1489-89-0) is a chemical compound with molecular formula C9H19O4P and molecular weight 222.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-diethoxyphosphoryl-2,2-dimethylpropan-1-one
Also Known As: Diaethyl-trimethylacetyl-phosphonat, Pivaloylphosphonic acid diethyl ester, 1-diethoxyphosphoryl-2,2-dimethylpropan-1-one, diethyl (2,2-dimethylpropanoyl)phosphonate, J1.884.804J
| Molecular Formula | C9H19O4P |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 2.8252 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.1021 |
| Heavy Atoms | 14 |
| Complexity | 231.68674 |
Chemical Identifiers
| CAS Number | 1489-89-0 |
|---|---|
| SMILES | CCOP(=O)(C(=O)C(C)(C)C)OCC |
Product Overview
Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester (CAS 1489-89-0), with molecular formula C9H19O4P and molecular weight 222.10 g/mol. IUPAC: 1-diethoxyphosphoryl-2,2-dimethylpropan-1-one.
Chemical Property Profile of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester
Property Insights of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester
The XLogP value of 2.8252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester has 0 hydrogen bond donor(s) and 4 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, (2,2-dimethyl-1-oxopropyl)-, diethyl ester?
The CAS number of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester is 1489-89-0.
What is the molecular formula of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester?
The molecular formula of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester is C9H19O4P.
What is the molecular weight of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester?
The molecular weight of Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester is 222.10 g/mol.
Where can I buy Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester?
You can request a quote for Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, 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, (2,2-dimethyl-1-oxopropyl)-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (2,2-dimethyl-1-oxopropyl)-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.