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Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester
TL;DR: Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester (CAS 17045-53-3) is a chemical compound with molecular formula C21H30O4P2 and molecular weight 408.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[dibutoxyphosphorylmethyl(phenyl)phosphoryl]benzene
Also Known As: [dibutoxyphosphorylmethyl(phenyl)phosphoryl]benzene|Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester|dibutyl diphenylphosphinylmethylphosphonate|dibutyl [(diphenylphosphoryl)methyl]phosphonate|(dibutoxyphosphorylmethyl-phenyl-phosphoryl)benzene
| Molecular Formula | C21H30O4P2 |
|---|---|
| Molecular Weight | 408.16 g/mol |
| LogP | 5.7845 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 408.16193 |
| Heavy Atoms | 27 |
| Complexity | 704.7658 |
Chemical Identifiers
| CAS Number | 17045-53-3 |
|---|---|
| SMILES | CCCCOP(=O)(CP(=O)(C1=CC=CC=C1)C2=CC=CC=C2)OCCCC |
Product Overview
Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester (CAS 17045-53-3), with molecular formula C21H30O4P2 and molecular weight 408.16 g/mol. IUPAC: [dibutoxyphosphorylmethyl(phenyl)phosphoryl]benzene.
Chemical Property Profile of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester
Property Insights of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester
The XLogP value of 5.7845 indicates that Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester?
The CAS number of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester is 17045-53-3.
What is the molecular formula of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester?
The molecular formula of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester is C21H30O4P2.
What is the molecular weight of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester?
The molecular weight of Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester is 408.16 g/mol.
Where can I buy Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester?
You can request a quote for Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, [(diphenylphosphinyl)methyl]-, dibutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.