Dibenzylphosphonoacetic acid
TL;DR: Dibenzylphosphonoacetic acid (CAS 53243-58-6) is a chemical compound with molecular formula C16H17O5P and molecular weight 320.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bis(phenylmethoxy)phosphorylacetic acid
Also Known As: DIBENZYLPHOSPHONOACETIC ACID, dibenzyl phosphonoacetic acid, 2-(dibenzyl phosphono)acetic acid, 2-bis(phenylmethoxy)phosphorylacetic Acid, alpha-dibenzylphosphonoacetic acid
| Molecular Formula | C16H17O5P |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 3.6977 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 320.08136 |
| Heavy Atoms | 22 |
| Complexity | 594.60046 |
Chemical Identifiers
| CAS Number | 53243-58-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COP(=O)(CC(=O)O)OCC2=CC=CC=C2 |
Product Overview
Dibenzylphosphonoacetic acid (CAS 53243-58-6), with molecular formula C16H17O5P and molecular weight 320.08 g/mol. IUPAC: 2-bis(phenylmethoxy)phosphorylacetic acid.
Chemical Property Profile of Dibenzylphosphonoacetic acid
Property Insights of Dibenzylphosphonoacetic acid
The XLogP value of 3.6977 indicates that Dibenzylphosphonoacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzylphosphonoacetic acid. Following Lipinski's Rule of Five, Dibenzylphosphonoacetic acid 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 Dibenzylphosphonoacetic acid?
The CAS number of Dibenzylphosphonoacetic acid is 53243-58-6.
What is the molecular formula of Dibenzylphosphonoacetic acid?
The molecular formula of Dibenzylphosphonoacetic acid is C16H17O5P.
What is the molecular weight of Dibenzylphosphonoacetic acid?
The molecular weight of Dibenzylphosphonoacetic acid is 320.08 g/mol.
Where can I buy Dibenzylphosphonoacetic acid?
You can request a quote for Dibenzylphosphonoacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzylphosphonoacetic acid?
Yes, KEHONG BIO provides custom synthesis services for Dibenzylphosphonoacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.