Diethyl (3-(triethoxysilyl)propyl)malonate
TL;DR: Diethyl (3-(triethoxysilyl)propyl)malonate (CAS 22408-96-4) is a chemical compound with molecular formula C16H32O7Si and molecular weight 364.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(3-triethoxysilylpropyl)propanedioate
Also Known As: Diethyl (3-(triethoxysilyl)propyl)malonate, diethyl[3- propyl]malonate, diethyl 2-(3-triethoxysilylpropyl)propanedioate, diethyl(triethoxysilylpropyl)malonate, diethyl[3-(triethoxysilyl)propyl]malonate
| Molecular Formula | C16H32O7Si |
|---|---|
| Molecular Weight | 364.19 g/mol |
| LogP | 2.56 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 364.19174 |
| Heavy Atoms | 24 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 22408-96-4 |
|---|---|
| SMILES | CCOC(=O)C(CCC[Si](OCC)(OCC)OCC)C(=O)OCC |
| InChIKey | RKNYOHXRCRXQOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl (3-(triethoxysilyl)propyl)malonate (CAS 22408-96-4), with molecular formula C16H32O7Si and molecular weight 364.19 g/mol. IUPAC: diethyl 2-(3-triethoxysilylpropyl)propanedioate.
Chemical Property Profile of Diethyl (3-(triethoxysilyl)propyl)malonate
Property Insights of Diethyl (3-(triethoxysilyl)propyl)malonate
The XLogP value of 2.56 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl (3-(triethoxysilyl)propyl)malonate. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl (3-(triethoxysilyl)propyl)malonate. Following Lipinski's Rule of Five, Diethyl (3-(triethoxysilyl)propyl)malonate has 0 hydrogen bond donor(s) and 7 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-(triethoxysilyl)propyl)malonate?
The CAS number of Diethyl (3-(triethoxysilyl)propyl)malonate is 22408-96-4.
What is the molecular formula of Diethyl (3-(triethoxysilyl)propyl)malonate?
The molecular formula of Diethyl (3-(triethoxysilyl)propyl)malonate is C16H32O7Si.
What is the molecular weight of Diethyl (3-(triethoxysilyl)propyl)malonate?
The molecular weight of Diethyl (3-(triethoxysilyl)propyl)malonate is 364.19 g/mol.
Where can I buy Diethyl (3-(triethoxysilyl)propyl)malonate?
You can request a quote for Diethyl (3-(triethoxysilyl)propyl)malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl (3-(triethoxysilyl)propyl)malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl (3-(triethoxysilyl)propyl)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.