2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
TL;DR: 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate (CAS 101198-12-3) is a chemical compound with molecular formula C18H29NO5Si and molecular weight 367.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
Also Known As: 2,2-Dimethyl-1,3-dioxa-6-aza-2-silacyclooctane-6-ethanol 2-methyl-3-phenoxypropionate, 2-(2,2-dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate, 1,3-Dioxa-6-aza-2-silacyclooctane-6-ethanol, 2,2-dimethyl-, 2-methyl-3-phenoxypropionate, 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl2-methyl-3-(phenoxy)propanoate, 1,3-Dioxa-6-aza-2-silacyclooctane-6-ethanol,2,2-dimethyl-,2-methyl-3-phenoxypropionate
| Molecular Formula | C18H29NO5Si |
|---|---|
| Molecular Weight | 367.18 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 367.1815 |
| Heavy Atoms | 25 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 101198-12-3 |
|---|---|
| SMILES | CC(COC1=CC=CC=C1)C(=O)OCCN2CCO[Si](OCC2)(C)C |
| InChIKey | ZIIDHPAOCIOQJO-UHFFFAOYSA-N |
Product Overview
2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate (CAS 101198-12-3), with molecular formula C18H29NO5Si and molecular weight 367.18 g/mol. IUPAC: 2-(2,2-dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate.
Chemical Property Profile of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
Property Insights of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate. With a topological polar surface area (TPSA) of 57.2 Ų, 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate has 0 hydrogen bond donor(s) and 6 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 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate?
The CAS number of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate is 101198-12-3.
What is the molecular formula of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate?
The molecular formula of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate is C18H29NO5Si.
What is the molecular weight of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate?
The molecular weight of 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate is 367.18 g/mol.
Where can I buy 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate?
You can request a quote for 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.