Phosphonic acid, diisotridecyl ester
TL;DR: Phosphonic acid, diisotridecyl ester (CAS 70956-02-4) is a chemical compound with molecular formula C26H54O3P+ and molecular weight 445.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(11-methyldodecoxy)-oxophosphanium
Also Known As: Diisotridecyl phosphonate, Diisotridecyl phosphite, Bis(isotridecyl) hydrogen phosphite, Phosphonic acid, diisotridecyl ester, EINECS 275-063-2
| Molecular Formula | C26H54O3P+ |
|---|---|
| Molecular Weight | 445.38 g/mol |
| LogP | 10.0108 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 24 |
| Exact Mass | 445.38104 |
| Heavy Atoms | 30 |
| Complexity | 326.18787 |
Chemical Identifiers
| CAS Number | 70956-02-4 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCO[P+](=O)OCCCCCCCCCCC(C)C |
Product Overview
Phosphonic acid, diisotridecyl ester (CAS 70956-02-4), with molecular formula C26H54O3P+ and molecular weight 445.38 g/mol. IUPAC: bis(11-methyldodecoxy)-oxophosphanium.
Chemical Property Profile of Phosphonic acid, diisotridecyl ester
Property Insights of Phosphonic acid, diisotridecyl ester
The XLogP value of 10.0108 indicates that Phosphonic acid, diisotridecyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Phosphonic acid, diisotridecyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, diisotridecyl ester 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 Phosphonic acid, diisotridecyl ester?
The CAS number of Phosphonic acid, diisotridecyl ester is 70956-02-4.
What is the molecular formula of Phosphonic acid, diisotridecyl ester?
The molecular formula of Phosphonic acid, diisotridecyl ester is C26H54O3P+.
What is the molecular weight of Phosphonic acid, diisotridecyl ester?
The molecular weight of Phosphonic acid, diisotridecyl ester is 445.38 g/mol.
Where can I buy Phosphonic acid, diisotridecyl ester?
You can request a quote for Phosphonic acid, diisotridecyl 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, diisotridecyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, diisotridecyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.