2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether
TL;DR: 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether (CAS 53583-35-0) is a chemical compound with molecular formula C10H10N2O7S and molecular weight 302.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dinitrophenoxy)thiolane 1,1-dioxide
Also Known As: 3-(2,4-dinitrophenoxy)thiolane-1,1-dione, 3-(2,4-dinitrophenoxy)thiolane 1,1-dioxide, 2,4-dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether
| Molecular Formula | C10H10N2O7S |
|---|---|
| Molecular Weight | 302.02 g/mol |
| LogP | 1.0689 |
| Topological Polar Surface Area | 129.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.02087 |
| Heavy Atoms | 20 |
| Complexity | 670.1837 |
Chemical Identifiers
| CAS Number | 53583-35-0 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether (CAS 53583-35-0), with molecular formula C10H10N2O7S and molecular weight 302.02 g/mol. IUPAC: 3-(2,4-dinitrophenoxy)thiolane 1,1-dioxide.
Chemical Property Profile of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether
Property Insights of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether
The XLogP value of 1.0689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether. The TPSA of 129.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether. Following Lipinski's Rule of Five, 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether 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 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether?
The CAS number of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether is 53583-35-0.
What is the molecular formula of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether?
The molecular formula of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether is C10H10N2O7S.
What is the molecular weight of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether?
The molecular weight of 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether is 302.02 g/mol.
Where can I buy 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether?
You can request a quote for 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dinitrophenyl 1,1-dioxidotetrahydrothiophen-3-yl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.