2-Ethyloctanedioic acid
TL;DR: 2-Ethyloctanedioic acid (CAS 3971-33-3) is a chemical compound with molecular formula C10H18O4 and molecular weight 202.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyloctanedioic acid
Also Known As: 2-Ethyloctanedioic acid, 2-ETHYLSUBERIC ACID, Octanedioic acid, 2-ethyl-, 2-Ethyl suberic acid, Ethyloctanedioic acid
| Molecular Formula | C10H18O4 |
|---|---|
| Molecular Weight | 202.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 202.12051 |
| Heavy Atoms | 14 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 3971-33-3 |
|---|---|
| SMILES | CCC(CCCCCC(=O)O)C(=O)O |
| InChIKey | WUDDSDIHJHPJRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethyloctanedioic acid (CAS 3971-33-3), with molecular formula C10H18O4 and molecular weight 202.12 g/mol. IUPAC: 2-ethyloctanedioic acid.
Chemical Property Profile of 2-Ethyloctanedioic acid
Property Insights of 2-Ethyloctanedioic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyloctanedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethyloctanedioic acid. Following Lipinski's Rule of Five, 2-Ethyloctanedioic acid has 2 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 2-Ethyloctanedioic acid?
The CAS number of 2-Ethyloctanedioic acid is 3971-33-3.
What is the molecular formula of 2-Ethyloctanedioic acid?
The molecular formula of 2-Ethyloctanedioic acid is C10H18O4.
What is the molecular weight of 2-Ethyloctanedioic acid?
The molecular weight of 2-Ethyloctanedioic acid is 202.12 g/mol.
Where can I buy 2-Ethyloctanedioic acid?
You can request a quote for 2-Ethyloctanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyloctanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyloctanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.