Diphenyl alpha-Chlorobenzylphosphonate
TL;DR: Diphenyl alpha-Chlorobenzylphosphonate (CAS 58744-06-2) is a chemical compound with molecular formula C19H16ClO3P and molecular weight 358.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[chloro(diphenoxyphosphoryl)methyl]benzene
Also Known As: Diphenyl alpha-Chlorobenzylphosphonate, [chloro(diphenoxyphosphoryl)methyl]benzene, Diphenyl (chloro(phenyl)methyl)phosphonate, Diphenyl, A-Chlorobenzylphosphonate
| Molecular Formula | C19H16ClO3P |
|---|---|
| Molecular Weight | 358.05 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.05255 |
| Heavy Atoms | 24 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 58744-06-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)Cl |
| InChIKey | LTRZPFCYQMGZGD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diphenyl alpha-Chlorobenzylphosphonate (CAS 58744-06-2), with molecular formula C19H16ClO3P and molecular weight 358.05 g/mol. IUPAC: [chloro(diphenoxyphosphoryl)methyl]benzene.
Chemical Property Profile of Diphenyl alpha-Chlorobenzylphosphonate
Property Insights of Diphenyl alpha-Chlorobenzylphosphonate
The XLogP value of 5.3 indicates that Diphenyl alpha-Chlorobenzylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Diphenyl alpha-Chlorobenzylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenyl alpha-Chlorobenzylphosphonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diphenyl alpha-Chlorobenzylphosphonate?
The CAS number of Diphenyl alpha-Chlorobenzylphosphonate is 58744-06-2.
What is the molecular formula of Diphenyl alpha-Chlorobenzylphosphonate?
The molecular formula of Diphenyl alpha-Chlorobenzylphosphonate is C19H16ClO3P.
What is the molecular weight of Diphenyl alpha-Chlorobenzylphosphonate?
The molecular weight of Diphenyl alpha-Chlorobenzylphosphonate is 358.05 g/mol.
Where can I buy Diphenyl alpha-Chlorobenzylphosphonate?
You can request a quote for Diphenyl alpha-Chlorobenzylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenyl alpha-Chlorobenzylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diphenyl alpha-Chlorobenzylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.