Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester
TL;DR: Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester (CAS 84006-72-4) is a chemical compound with molecular formula C23H36O5 and molecular weight 392.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenoxyacetyl)oxybutan-2-yl undecanoate
Also Known As: 1-Methyl-2-((phenoxyacetyl)oxy)propyl undecanoate, 3-(2-phenoxyacetyl)oxybutan-2-yl undecanoate, Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester, 3-[(Phenoxyacetyl)oxy]butan-2-yl undecanoate, Pentanoic acid,3-methyl-,1,2-dimethyl-1,2-ethanediyl ester
| Molecular Formula | C23H36O5 |
|---|---|
| Molecular Weight | 392.26 g/mol |
| LogP | 5.4596 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 392.2563 |
| Heavy Atoms | 28 |
| Complexity | 543.1835 |
Chemical Identifiers
| CAS Number | 84006-72-4 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)OC(C)C(C)OC(=O)COC1=CC=CC=C1 |
Product Overview
Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester (CAS 84006-72-4), with molecular formula C23H36O5 and molecular weight 392.26 g/mol. IUPAC: 3-(2-phenoxyacetyl)oxybutan-2-yl undecanoate.
Chemical Property Profile of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester
Property Insights of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester
The XLogP value of 5.4596 indicates that Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester. Following Lipinski's Rule of Five, Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester?
The CAS number of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester is 84006-72-4.
What is the molecular formula of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester?
The molecular formula of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester is C23H36O5.
What is the molecular weight of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester?
The molecular weight of Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester is 392.26 g/mol.
Where can I buy Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester?
You can request a quote for Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Undecanoic acid, 1-methyl-2-((phenoxyacetyl)oxy)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.