Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester
TL;DR: Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester (CAS 13644-14-9) is a chemical compound with molecular formula C12H16N2O6Si and molecular weight 312.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Also Known As: 1-(p-Nitrophenoxy)silatrane, 1-(p-Nitrophenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane, J1.846.681C, Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-nitrophenoxy)-
| Molecular Formula | C12H16N2O6Si |
|---|---|
| Molecular Weight | 312.08 g/mol |
| LogP | 0.7882 |
| Topological Polar Surface Area | 86.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.07776 |
| Heavy Atoms | 21 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 13644-14-9 |
|---|---|
| SMILES | C1CO[Si]2(OCCN1CCO2)OC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | PJFASTGJUUIVKV-UHFFFAOYSA-N |
Product Overview
Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester (CAS 13644-14-9), with molecular formula C12H16N2O6Si and molecular weight 312.08 g/mol. IUPAC: 1-(4-nitrophenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane.
Chemical Property Profile of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester
Property Insights of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester
The XLogP value of 0.7882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester. The TPSA of 86.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester. Following Lipinski's Rule of Five, Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester 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 Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester?
The CAS number of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester is 13644-14-9.
What is the molecular formula of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester?
The molecular formula of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester is C12H16N2O6Si.
What is the molecular weight of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester?
The molecular weight of Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester is 312.08 g/mol.
Where can I buy Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester?
You can request a quote for Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl 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 (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Silicic acid (H4SiO4), cyclic nitrilotriethylene p-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.