2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯
TL;DR: 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 (CAS 16522-51-3) is a chemical compound with molecular formula C13H20O3Si and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯
2,2-diethoxy-4,5-dihydro-3H-1,2-benzoxasilepine
Also Known As: 2,2-Diethoxy-2,3,4,5-tetrahydro-1,2-benzoxasilepin, 2,2-diethoxy-4,5-dihydro-3H-1,2-benzoxasilepine, 2,2-diethoxy-2,3,4,5-tetrahydro-1,2-benzoxasilepine, 1,2-Benzoxasilepin,2,2-diethoxy-2,3,4,5-tetrahydro-, 1,2-Benzoxasilepin, 2,2-diethoxy-2,3,4,5-tetrahydro-
| Molecular Formula | C13H20O3Si |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 3.02 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11816 |
| Heavy Atoms | 17 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 16522-51-3 |
|---|---|
| SMILES | CCO[Si]1(CCCC2=CC=CC=C2O1)OCC |
| InChIKey | LRRFYEVAVAPJFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 (CAS 16522-51-3), with molecular formula C13H20O3Si and molecular weight 252.12 g/mol. IUPAC: 2,2-diethoxy-4,5-dihydro-3H-1,2-benzoxasilepine.
Chemical Property Profile of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯
Property Insights of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯
The XLogP value of 3.02 indicates that 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 has 0 hydrogen bond donor(s) and 3 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 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯?
The CAS number of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 is 16522-51-3.
What is the molecular formula of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯?
The molecular formula of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 is C13H20O3Si.
What is the molecular weight of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯?
The molecular weight of 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 is 252.12 g/mol.
Where can I buy 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯?
You can request a quote for 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯?
Yes, KEHONG BIO provides custom synthesis services for 2,2-二乙氧基-2,3,4,5-四氢-1,2-苯并氧杂硅环庚烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.