Diethyl 4-Acetamidobenzylphosphonate
TL;DR: Diethyl 4-Acetamidobenzylphosphonate (CAS 118578-84-0) is a chemical compound with molecular formula C13H20NO4P and molecular weight 285.113 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-(diethoxyphosphorylmethyl)phenyl]acetamide
Also Known As: Diethyl 4-Acetamidobenzylphosphonate, diethyl p-acetylaminobenzylphosphonate, diethyl [(4-acetamidophenyl)methyl]phosphonate, N-[4-(diethoxyphosphorylmethyl)phenyl]acetamide, 4-(Acetylamino)benzyldiethoxyphosphine oxide
Technical Specifications
| Molecular Formula | C13H20NO4P |
| Molecular Weight | 285.113 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 285.113 Da |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)NC(=O)C)OCC |
| InChIKey | LSQQRLOYPDMBGI-UHFFFAOYSA-N |
Chemical Property Profile of Diethyl 4-Acetamidobenzylphosphonate
Property Insights of Diethyl 4-Acetamidobenzylphosphonate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 4-Acetamidobenzylphosphonate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4-Acetamidobenzylphosphonate. Following Lipinski's Rule of Five, Diethyl 4-Acetamidobenzylphosphonate 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
What is the CAS number of Diethyl 4-Acetamidobenzylphosphonate?
The CAS number of Diethyl 4-Acetamidobenzylphosphonate is 118578-84-0.
What is the molecular formula of Diethyl 4-Acetamidobenzylphosphonate?
The molecular formula of Diethyl 4-Acetamidobenzylphosphonate is C13H20NO4P.
What is the molecular weight of Diethyl 4-Acetamidobenzylphosphonate?
The molecular weight of Diethyl 4-Acetamidobenzylphosphonate is 285.113 g/mol.
Where can I buy Diethyl 4-Acetamidobenzylphosphonate?
You can request a quote for Diethyl 4-Acetamidobenzylphosphonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethyl 4-Acetamidobenzylphosphonate?
Yes, CoreyChem provides custom synthesis services for Diethyl 4-Acetamidobenzylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.