5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate
TL;DR: 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate (CAS 128237-30-9) is a chemical compound with molecular formula C11H20O5 and molecular weight 232.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate
Also Known As: 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate, tert-Butyl ethyl 3-hydroxypentanedioate, (R)-3-HYDROXYGLUTARATE ETHYL TERT-BUTYL, 1-TERT-BUTYL 5-ETHYL 3-HYDROXYPENTANEDIOATE, TERT-BUTYL ETHYL (R)-3-HYDRO-XYGLUTARATE
| Molecular Formula | C11H20O5 |
|---|---|
| Molecular Weight | 232.13 g/mol |
| LogP | 1.0323 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 232.13107 |
| Heavy Atoms | 16 |
| Complexity | 241.2497 |
Chemical Identifiers
| CAS Number | 128237-30-9 |
|---|---|
| SMILES | CCOC(=O)CC(CC(=O)OC(C)(C)C)O |
Product Overview
5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate (CAS 128237-30-9), with molecular formula C11H20O5 and molecular weight 232.13 g/mol. IUPAC: 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate.
Chemical Property Profile of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate
Property Insights of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate
The XLogP value of 1.0323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate. Following Lipinski's Rule of Five, 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate has 1 hydrogen bond donor(s) and 5 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 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate?
The CAS number of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate is 128237-30-9.
What is the molecular formula of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate?
The molecular formula of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate is C11H20O5.
What is the molecular weight of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate?
The molecular weight of 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate is 232.13 g/mol.
Where can I buy 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate?
You can request a quote for 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate?
Yes, KEHONG BIO provides custom synthesis services for 5-O-tert-butyl 1-O-ethyl 3-hydroxypentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.