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Diethyl[(ethylamino)(phenyl)methyl]phosphonate
TL;DR: Diethyl[(ethylamino)(phenyl)methyl]phosphonate (CAS 66753-48-8) is a chemical compound with molecular formula C13H22NO3P and molecular weight 271.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[diethoxyphosphoryl(phenyl)methyl]ethanamine
Also Known As: NCIOpen2_003244, diethyl[(ethylamino)(phenyl)methyl]phosphonate, N-[diethoxyphosphoryl(phenyl)methyl]ethanamine, Diethyl ((ethylamino)(phenyl)methyl)phosphonate, diethyl [(ethylamino)(phenyl)methyl]phosphonate
| Molecular Formula | C13H22NO3P |
|---|---|
| Molecular Weight | 271.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 271.13373 |
| Heavy Atoms | 18 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 66753-48-8 |
|---|---|
| SMILES | CCNC(C1=CC=CC=C1)P(=O)(OCC)OCC |
| InChIKey | PKVYTCDYMVCIBP-UHFFFAOYSA-N |
Product Overview
Diethyl[(ethylamino)(phenyl)methyl]phosphonate (CAS 66753-48-8), with molecular formula C13H22NO3P and molecular weight 271.13 g/mol. IUPAC: N-[diethoxyphosphoryl(phenyl)methyl]ethanamine.
Chemical Property Profile of Diethyl[(ethylamino)(phenyl)methyl]phosphonate
Property Insights of Diethyl[(ethylamino)(phenyl)methyl]phosphonate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl[(ethylamino)(phenyl)methyl]phosphonate. With a topological polar surface area (TPSA) of 47.6 Ų, Diethyl[(ethylamino)(phenyl)methyl]phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl[(ethylamino)(phenyl)methyl]phosphonate has 1 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 Diethyl[(ethylamino)(phenyl)methyl]phosphonate?
The CAS number of Diethyl[(ethylamino)(phenyl)methyl]phosphonate is 66753-48-8.
What is the molecular formula of Diethyl[(ethylamino)(phenyl)methyl]phosphonate?
The molecular formula of Diethyl[(ethylamino)(phenyl)methyl]phosphonate is C13H22NO3P.
What is the molecular weight of Diethyl[(ethylamino)(phenyl)methyl]phosphonate?
The molecular weight of Diethyl[(ethylamino)(phenyl)methyl]phosphonate is 271.13 g/mol.
Where can I buy Diethyl[(ethylamino)(phenyl)methyl]phosphonate?
You can request a quote for Diethyl[(ethylamino)(phenyl)methyl]phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl[(ethylamino)(phenyl)methyl]phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl[(ethylamino)(phenyl)methyl]phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.