Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide
TL;DR: Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide (CAS 72304-80-4) is a chemical compound with molecular formula C6H13O5P and molecular weight 196.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl dimethoxyphosphorylformate
Also Known As: Dimethyl i-propoxycarbonylphosphonate, isopropyl dimethoxyphosphorylformate, propan-2-yl dimethoxyphosphorylformate, isopropyl dimethoxyphosphinecarboxylate oxide, Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide
| Molecular Formula | C6H13O5P |
|---|---|
| Molecular Weight | 196.05 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 196.05006 |
| Heavy Atoms | 12 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 72304-80-4 |
|---|---|
| SMILES | CC(C)OC(=O)P(=O)(OC)OC |
| InChIKey | TTYOCFPPDNHPRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide (CAS 72304-80-4), with molecular formula C6H13O5P and molecular weight 196.05 g/mol. IUPAC: propan-2-yl dimethoxyphosphorylformate.
Chemical Property Profile of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide
Property Insights of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide. Following Lipinski's Rule of Five, Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide 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 Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide?
The CAS number of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide is 72304-80-4.
What is the molecular formula of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide?
The molecular formula of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide is C6H13O5P.
What is the molecular weight of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide?
The molecular weight of Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide is 196.05 g/mol.
Where can I buy Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide?
You can request a quote for Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide?
Yes, KEHONG BIO provides custom synthesis services for Phosphinecarboxylic acid, dimethoxy-, 1-methylethyl ester, oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.