Methyl 2,3-dimethylhexadec-2-enoate
TL;DR: Methyl 2,3-dimethylhexadec-2-enoate (CAS 57289-46-0) is a chemical compound with molecular formula C19H36O2 and molecular weight 296.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,3-dimethylhexadec-2-enoate
Also Known As: D-Arabonsaeure-5-phosphat, methyl 2,3-dimethylhexadec-2-enoate, Methyl (2Z)-2,3-dimethyl-2-hexadecenoate, 2-Hexadecenoic acid, 2,3-dimethyl-, methyl ester, (Z)-
| Molecular Formula | C19H36O2 |
|---|---|
| Molecular Weight | 296.27 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 296.27155 |
| Heavy Atoms | 21 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 57289-46-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(=C(C)C(=O)OC)C |
| InChIKey | SZDCOGHMRNFKEI-UHFFFAOYSA-N |
Product Overview
Methyl 2,3-dimethylhexadec-2-enoate (CAS 57289-46-0), with molecular formula C19H36O2 and molecular weight 296.27 g/mol. IUPAC: methyl 2,3-dimethylhexadec-2-enoate.
Chemical Property Profile of Methyl 2,3-dimethylhexadec-2-enoate
Property Insights of Methyl 2,3-dimethylhexadec-2-enoate
The XLogP value of 8.3 indicates that Methyl 2,3-dimethylhexadec-2-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, Methyl 2,3-dimethylhexadec-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2,3-dimethylhexadec-2-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 Methyl 2,3-dimethylhexadec-2-enoate?
The CAS number of Methyl 2,3-dimethylhexadec-2-enoate is 57289-46-0.
What is the molecular formula of Methyl 2,3-dimethylhexadec-2-enoate?
The molecular formula of Methyl 2,3-dimethylhexadec-2-enoate is C19H36O2.
What is the molecular weight of Methyl 2,3-dimethylhexadec-2-enoate?
The molecular weight of Methyl 2,3-dimethylhexadec-2-enoate is 296.27 g/mol.
Where can I buy Methyl 2,3-dimethylhexadec-2-enoate?
You can request a quote for Methyl 2,3-dimethylhexadec-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,3-dimethylhexadec-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,3-dimethylhexadec-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.