3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物
TL;DR: 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 (CAS 92923-32-5) is a chemical compound with molecular formula C13H17NO6S and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物
3,3-diethoxy-2-(4-nitrophenyl)thietane 1,1-dioxide
Also Known As: 3,3-diethoxy-2-(4-nitrophenyl)thietane 1,1-dioxide, (4-(3,3-Diethoxy-1,1-dioxido-2-thietanyl)phenyl)(hydroxy)azane oxide, 3.3-Diaethoxy-2-(p-nitrophenyl)-thietan-1.1-dioxid
| Molecular Formula | C13H17NO6S |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.07767 |
| Heavy Atoms | 21 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 92923-32-5 |
|---|---|
| SMILES | CCOC1(CS(=O)(=O)C1C2=CC=C(C=C2)[N+](=O)[O-])OCC |
| InChIKey | GXNJEKSQCKONQD-UHFFFAOYSA-N |
Product Overview
3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 (CAS 92923-32-5), with molecular formula C13H17NO6S and molecular weight 315.08 g/mol. IUPAC: 3,3-diethoxy-2-(4-nitrophenyl)thietane 1,1-dioxide.
Chemical Property Profile of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物
Property Insights of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物. Following Lipinski's Rule of Five, 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 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 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物?
The CAS number of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 is 92923-32-5.
What is the molecular formula of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物?
The molecular formula of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 is C13H17NO6S.
What is the molecular weight of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物?
The molecular weight of 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 is 315.08 g/mol.
Where can I buy 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物?
You can request a quote for 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物?
Yes, KEHONG BIO provides custom synthesis services for 3,3-二乙氧基-2-(4-硝基苯基)硫杂环丁烷1,1-二氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.