Diethyl 3-hydroxy-3-methylglutarate
TL;DR: Diethyl 3-hydroxy-3-methylglutarate (CAS 73489-84-6) is a chemical compound with molecular formula C10H18O5 and molecular weight 218.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3-hydroxy-3-methylpentanedioate
Also Known As: Diethyl 3-hydroxy-3-methylglutarate, diethyl 3-hydroxy-3-methylpentanedioate, EINECS 277-481-0, 3-Hydroxy-3-methyl-glutaric acid diethyl ester, 3-Hydroxy-3-methylpentanedioic acid diethyl ester
| Molecular Formula | C10H18O5 |
|---|---|
| Molecular Weight | 218.12 g/mol |
| LogP | 0.6438 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.11542 |
| Heavy Atoms | 15 |
| Complexity | 199.85263 |
Chemical Identifiers
| CAS Number | 73489-84-6 |
|---|---|
| SMILES | CCOC(=O)CC(C)(CC(=O)OCC)O |
Product Overview
Diethyl 3-hydroxy-3-methylglutarate (CAS 73489-84-6), with molecular formula C10H18O5 and molecular weight 218.12 g/mol. IUPAC: diethyl 3-hydroxy-3-methylpentanedioate.
Chemical Property Profile of Diethyl 3-hydroxy-3-methylglutarate
Property Insights of Diethyl 3-hydroxy-3-methylglutarate
The XLogP value of 0.6438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 3-hydroxy-3-methylglutarate. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 3-hydroxy-3-methylglutarate. Following Lipinski's Rule of Five, Diethyl 3-hydroxy-3-methylglutarate 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 Diethyl 3-hydroxy-3-methylglutarate?
The CAS number of Diethyl 3-hydroxy-3-methylglutarate is 73489-84-6.
What is the molecular formula of Diethyl 3-hydroxy-3-methylglutarate?
The molecular formula of Diethyl 3-hydroxy-3-methylglutarate is C10H18O5.
What is the molecular weight of Diethyl 3-hydroxy-3-methylglutarate?
The molecular weight of Diethyl 3-hydroxy-3-methylglutarate is 218.12 g/mol.
Where can I buy Diethyl 3-hydroxy-3-methylglutarate?
You can request a quote for Diethyl 3-hydroxy-3-methylglutarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3-hydroxy-3-methylglutarate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3-hydroxy-3-methylglutarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.