2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate
TL;DR: 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate (CAS 41240-94-2) is a chemical compound with molecular formula C38H74O4 and molecular weight 594.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(16-methylheptadecanoyloxy)ethyl 16-methylheptadecanoate
Also Known As: Polyethyleneglycol, diisostearate, Diisostearic acid ethylene glycol, J3.540.357D, Bis(16-methylheptadecanoic acid)ethylene ester, 2-(16-methylheptadecanoyloxy)ethyl 16-methylheptadecanoate
| Molecular Formula | C38H74O4 |
|---|---|
| Molecular Weight | 594.56 g/mol |
| LogP | 16.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 35 |
| Exact Mass | 594.5587 |
| Heavy Atoms | 42 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 41240-94-2 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCC(C)C |
| InChIKey | IENIFXNJFLJZGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate (CAS 41240-94-2), with molecular formula C38H74O4 and molecular weight 594.56 g/mol. IUPAC: 2-(16-methylheptadecanoyloxy)ethyl 16-methylheptadecanoate.
Chemical Property Profile of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate
Property Insights of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate
The XLogP value of 16.2 indicates that 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate 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 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate?
The CAS number of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate is 41240-94-2.
What is the molecular formula of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate?
The molecular formula of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate is C38H74O4.
What is the molecular weight of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate?
The molecular weight of 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate is 594.56 g/mol.
Where can I buy 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate?
You can request a quote for 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(16-Methylheptadecanoyloxy)ethyl 16-methylheptadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.