Diethyl amino(4-methoxyphenyl)methylphosphonate
TL;DR: Diethyl amino(4-methoxyphenyl)methylphosphonate (CAS 16656-52-3) is a chemical compound with molecular formula C12H20NO4P and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxyphosphoryl-(4-methoxyphenyl)methanamine
Also Known As: Diethyl amino(4-methoxyphenyl)methylphosphonate, diethoxyphosphoryl-(4-methoxyphenyl)methanamine, diethyl [amino(4-methoxyphenyl)methyl]phosphonate, alpha-Amino-p-methoxybenzylphosphonic acid diethyl ester
| Molecular Formula | C12H20NO4P |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 273.113 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 16656-52-3 |
|---|---|
| SMILES | CCOP(=O)(C(C1=CC=C(C=C1)OC)N)OCC |
| InChIKey | LUCBUBZCLGCAFD-UHFFFAOYSA-N |
Product Overview
Diethyl amino(4-methoxyphenyl)methylphosphonate (CAS 16656-52-3), with molecular formula C12H20NO4P and molecular weight 273.11 g/mol. IUPAC: diethoxyphosphoryl-(4-methoxyphenyl)methanamine.
Chemical Property Profile of Diethyl amino(4-methoxyphenyl)methylphosphonate
Property Insights of Diethyl amino(4-methoxyphenyl)methylphosphonate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl amino(4-methoxyphenyl)methylphosphonate. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl amino(4-methoxyphenyl)methylphosphonate. Following Lipinski's Rule of Five, Diethyl amino(4-methoxyphenyl)methylphosphonate has 1 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 Diethyl amino(4-methoxyphenyl)methylphosphonate?
The CAS number of Diethyl amino(4-methoxyphenyl)methylphosphonate is 16656-52-3.
What is the molecular formula of Diethyl amino(4-methoxyphenyl)methylphosphonate?
The molecular formula of Diethyl amino(4-methoxyphenyl)methylphosphonate is C12H20NO4P.
What is the molecular weight of Diethyl amino(4-methoxyphenyl)methylphosphonate?
The molecular weight of Diethyl amino(4-methoxyphenyl)methylphosphonate is 273.11 g/mol.
Where can I buy Diethyl amino(4-methoxyphenyl)methylphosphonate?
You can request a quote for Diethyl amino(4-methoxyphenyl)methylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl amino(4-methoxyphenyl)methylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl amino(4-methoxyphenyl)methylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.