Silicic acid, cyclic nitrilotriethylene thymyl ester
TL;DR: Silicic acid, cyclic nitrilotriethylene thymyl ester (CAS 13644-10-5) is a chemical compound with molecular formula C16H25NO4Si and molecular weight 323.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-methyl-2-propan-2-ylphenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Also Known As: Silicic acid, cyclic nitrilotriethylene thymyl ester, Silicic acid, cyclic nitrilotriethylene thymyl ester (8CI), Silicic acid, thymyl ester, cyclic ester with 2,2',2''-nitrilotriethanol, 1-(2-(1-Methylethyl)-5-methylphenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(2-(1-methylethyl)-5-methylphenoxy)-
| Molecular Formula | C16H25NO4Si |
|---|---|
| Molecular Weight | 323.16 g/mol |
| LogP | 2.31182 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.15527 |
| Heavy Atoms | 22 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 13644-10-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)O[Si]23OCCN(CCO2)CCO3 |
| InChIKey | PMVQSGAQEXDYGW-UHFFFAOYSA-N |
Product Overview
Silicic acid, cyclic nitrilotriethylene thymyl ester (CAS 13644-10-5), with molecular formula C16H25NO4Si and molecular weight 323.16 g/mol. IUPAC: 1-(5-methyl-2-propan-2-ylphenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane.
Chemical Property Profile of Silicic acid, cyclic nitrilotriethylene thymyl ester
Property Insights of Silicic acid, cyclic nitrilotriethylene thymyl ester
The XLogP value of 2.31182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Silicic acid, cyclic nitrilotriethylene thymyl ester. With a topological polar surface area (TPSA) of 40.2 Ų, Silicic acid, cyclic nitrilotriethylene thymyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Silicic acid, cyclic nitrilotriethylene thymyl ester has 0 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 Silicic acid, cyclic nitrilotriethylene thymyl ester?
The CAS number of Silicic acid, cyclic nitrilotriethylene thymyl ester is 13644-10-5.
What is the molecular formula of Silicic acid, cyclic nitrilotriethylene thymyl ester?
The molecular formula of Silicic acid, cyclic nitrilotriethylene thymyl ester is C16H25NO4Si.
What is the molecular weight of Silicic acid, cyclic nitrilotriethylene thymyl ester?
The molecular weight of Silicic acid, cyclic nitrilotriethylene thymyl ester is 323.16 g/mol.
Where can I buy Silicic acid, cyclic nitrilotriethylene thymyl ester?
You can request a quote for Silicic acid, cyclic nitrilotriethylene thymyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Silicic acid, cyclic nitrilotriethylene thymyl ester?
Yes, KEHONG BIO provides custom synthesis services for Silicic acid, cyclic nitrilotriethylene thymyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.