戊二酸二正丁酯
TL;DR: 戊二酸二正丁酯 (CAS 6624-57-3) 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.
戊二酸二正丁酯
dibutyl pentanedioate
Also Known As: Dibutyl glutarate, Dibutyl pentanedioate, di-n-butyl glutarate, Glutaric acid, dibutyl ester, butyl glutarate
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 2.7 |
| 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 | 6624-57-3 |
|---|---|
| SMILES | CCCCOC(=O)CCCC(=O)OCCCC |
| InChIKey | ISXDVFNOXYQPIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
戊二酸二正丁酯 (CAS 6624-57-3), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: dibutyl pentanedioate.
Chemical Property Profile of 戊二酸二正丁酯
Property Insights of 戊二酸二正丁酯
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 戊二酸二正丁酯. With a topological polar surface area (TPSA) of 52.6 Ų, 戊二酸二正丁酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 戊二酸二正丁酯 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 戊二酸二正丁酯?
The CAS number of 戊二酸二正丁酯 is 6624-57-3.
What is the molecular formula of 戊二酸二正丁酯?
The molecular formula of 戊二酸二正丁酯 is C13H24O4.
What is the molecular weight of 戊二酸二正丁酯?
The molecular weight of 戊二酸二正丁酯 is 244.17 g/mol.
Where can I buy 戊二酸二正丁酯?
You can request a quote for 戊二酸二正丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 戊二酸二正丁酯?
Yes, KEHONG BIO provides custom synthesis services for 戊二酸二正丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.