Diethyl pimelate
TL;DR: Diethyl pimelate (CAS 2050-20-6) is a chemical compound with molecular formula C11H20O4 and molecular weight 216.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl heptanedioate
Also Known As: DIETHYL PIMELATE, Diethyl heptanedioate, Diethylpimelate, Heptanedioic acid, diethyl ester, Pimelic acid diethyl ester
| Molecular Formula | C11H20O4 |
|---|---|
| Molecular Weight | 216.14 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 216.13615 |
| Heavy Atoms | 15 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 2050-20-6 |
|---|---|
| SMILES | CCOC(=O)CCCCCC(=O)OCC |
| InChIKey | LKKOGZVQGQUVHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl pimelate (CAS 2050-20-6), with molecular formula C11H20O4 and molecular weight 216.14 g/mol. IUPAC: diethyl heptanedioate.
Chemical Property Profile of Diethyl pimelate
Property Insights of Diethyl pimelate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl pimelate. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl pimelate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl pimelate has 0 hydrogen bond donor(s) and 4 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 Diethyl pimelate?
The CAS number of Diethyl pimelate is 2050-20-6.
What is the molecular formula of Diethyl pimelate?
The molecular formula of Diethyl pimelate is C11H20O4.
What is the molecular weight of Diethyl pimelate?
The molecular weight of Diethyl pimelate is 216.14 g/mol.
Where can I buy Diethyl pimelate?
You can request a quote for Diethyl pimelate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl pimelate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl pimelate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.