Dimethyl undecanedioate
TL;DR: Dimethyl undecanedioate (CAS 4567-98-0) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl undecanedioate
Also Known As: Dimethyl undecanedioate, Dimethylundecanedioate, 1,11-dimethyl undecanedioate, undecanedioic acid dimethyl ester, Dimethyl 1,9-nonanedicarboxylate
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 4567-98-0 |
|---|---|
| SMILES | COC(=O)CCCCCCCCCC(=O)OC |
| InChIKey | LADJFIHHYMBJHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl undecanedioate (CAS 4567-98-0), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: dimethyl undecanedioate.
Chemical Property Profile of Dimethyl undecanedioate
Property Insights of Dimethyl undecanedioate
The XLogP value of 3.5 indicates that Dimethyl undecanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl undecanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl undecanedioate 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 Dimethyl undecanedioate?
The CAS number of Dimethyl undecanedioate is 4567-98-0.
What is the molecular formula of Dimethyl undecanedioate?
The molecular formula of Dimethyl undecanedioate is C13H24O4.
What is the molecular weight of Dimethyl undecanedioate?
The molecular weight of Dimethyl undecanedioate is 244.17 g/mol.
Where can I buy Dimethyl undecanedioate?
You can request a quote for Dimethyl undecanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl undecanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl undecanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.