异十三烷基磷酸酯
TL;DR: 异十三烷基磷酸酯 (CAS 52933-07-0) is a chemical compound with molecular formula C13H31O5P and molecular weight 298.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异十三烷基磷酸酯
11-methyldodecan-1-ol;phosphoric acid
Also Known As: isotridecyl phosphate, BEYCOSTAT A 130, PHOSLEX A 13, BUTOXYPHOSPHONIC ACID, Phosphoric acid, isotridecyl ester
| Molecular Formula | C13H31O5P |
|---|---|
| Molecular Weight | 298.19 g/mol |
| LogP | 3.22 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 298.19092 |
| Heavy Atoms | 19 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 52933-07-0 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCO.OP(=O)(O)O |
| InChIKey | BZZRUHJGDOBTJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异十三烷基磷酸酯 (CAS 52933-07-0), with molecular formula C13H31O5P and molecular weight 298.19 g/mol. IUPAC: 11-methyldodecan-1-ol;phosphoric acid.
Chemical Property Profile of 异十三烷基磷酸酯
Property Insights of 异十三烷基磷酸酯
The XLogP value of 3.22 indicates that 异十三烷基磷酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 异十三烷基磷酸酯. Following Lipinski's Rule of Five, 异十三烷基磷酸酯 has 4 hydrogen bond donor(s) and 5 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 异十三烷基磷酸酯?
The CAS number of 异十三烷基磷酸酯 is 52933-07-0.
What is the molecular formula of 异十三烷基磷酸酯?
The molecular formula of 异十三烷基磷酸酯 is C13H31O5P.
What is the molecular weight of 异十三烷基磷酸酯?
The molecular weight of 异十三烷基磷酸酯 is 298.19 g/mol.
Where can I buy 异十三烷基磷酸酯?
You can request a quote for 异十三烷基磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异十三烷基磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 异十三烷基磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.