Heptyl methacryate
TL;DR: Heptyl methacryate (CAS 5459-37-0) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 2-methylprop-2-enoate
Also Known As: Heptyl methacrylate, n-Heptyl methacrylate, Heptyl methacryate, heptyl 2-methylprop-2-enoate, Methacrylic acid, heptyl ester
| Molecular Formula | C11H20O2 |
|---|---|
| Molecular Weight | 184.15 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 184.14633 |
| Heavy Atoms | 13 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 5459-37-0 |
|---|---|
| SMILES | CCCCCCCOC(=O)C(=C)C |
| InChIKey | MDNFYIAABKQDML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptyl methacryate (CAS 5459-37-0), with molecular formula C11H20O2 and molecular weight 184.15 g/mol. IUPAC: heptyl 2-methylprop-2-enoate.
Chemical Property Profile of Heptyl methacryate
Property Insights of Heptyl methacryate
The XLogP value of 4.5 indicates that Heptyl methacryate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Heptyl methacryate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl methacryate has 0 hydrogen bond donor(s) and 2 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 Heptyl methacryate?
The CAS number of Heptyl methacryate is 5459-37-0.
What is the molecular formula of Heptyl methacryate?
The molecular formula of Heptyl methacryate is C11H20O2.
What is the molecular weight of Heptyl methacryate?
The molecular weight of Heptyl methacryate is 184.15 g/mol.
Where can I buy Heptyl methacryate?
You can request a quote for Heptyl methacryate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl methacryate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl methacryate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.