2-Methylpropyl docos-13-enoate
TL;DR: 2-Methylpropyl docos-13-enoate (CAS 19773-50-3) is a chemical compound with molecular formula C26H50O2 and molecular weight 394.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl docos-13-enoate
Also Known As: Isobutyl (Z)-docos-13-enoate, 13-Docosenoic acid,2-methylpropyl ester, (13Z)-
| Molecular Formula | C26H50O2 |
|---|---|
| Molecular Weight | 394.38 g/mol |
| LogP | 11.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 22 |
| Exact Mass | 394.38107 |
| Heavy Atoms | 28 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 19773-50-3 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC(C)C |
| InChIKey | VTAMRSRSTWWDEQ-UHFFFAOYSA-N |
Product Overview
2-Methylpropyl docos-13-enoate (CAS 19773-50-3), with molecular formula C26H50O2 and molecular weight 394.38 g/mol. IUPAC: 2-methylpropyl docos-13-enoate.
Chemical Property Profile of 2-Methylpropyl docos-13-enoate
Property Insights of 2-Methylpropyl docos-13-enoate
The XLogP value of 11.1 indicates that 2-Methylpropyl docos-13-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methylpropyl docos-13-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpropyl docos-13-enoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methylpropyl docos-13-enoate?
The CAS number of 2-Methylpropyl docos-13-enoate is 19773-50-3.
What is the molecular formula of 2-Methylpropyl docos-13-enoate?
The molecular formula of 2-Methylpropyl docos-13-enoate is C26H50O2.
What is the molecular weight of 2-Methylpropyl docos-13-enoate?
The molecular weight of 2-Methylpropyl docos-13-enoate is 394.38 g/mol.
Where can I buy 2-Methylpropyl docos-13-enoate?
You can request a quote for 2-Methylpropyl docos-13-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylpropyl docos-13-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylpropyl docos-13-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.