Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester
TL;DR: Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester (CAS 88968-97-2) is a chemical compound with molecular formula C12H17O6P and molecular weight 288.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl 2-dimethoxyphosphorylacetate
Also Known As: (4-methoxyphenyl)methyl 2-dimethoxyphosphorylacetate, (4-Methoxyphenyl)methyl (dimethoxyphosphoryl)acetate, Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester
| Molecular Formula | C12H17O6P |
|---|---|
| Molecular Weight | 288.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 288.07626 |
| Heavy Atoms | 19 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 88968-97-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)COC(=O)CP(=O)(OC)OC |
| InChIKey | DTAMRKNSRMZPMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester (CAS 88968-97-2), with molecular formula C12H17O6P and molecular weight 288.08 g/mol. IUPAC: (4-methoxyphenyl)methyl 2-dimethoxyphosphorylacetate.
Chemical Property Profile of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester
Property Insights of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester. Following Lipinski's Rule of Five, Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester has 0 hydrogen bond donor(s) and 6 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 Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester?
The CAS number of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester is 88968-97-2.
What is the molecular formula of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester?
The molecular formula of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester is C12H17O6P.
What is the molecular weight of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester?
The molecular weight of Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester is 288.08 g/mol.
Where can I buy Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester?
You can request a quote for Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-(dimethoxyphosphinyl)-, (4-methoxyphenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.