1-Phenoxathiinethanol, 10,10-dioxide
TL;DR: 1-Phenoxathiinethanol, 10,10-dioxide (CAS 134476-37-2) is a chemical compound with molecular formula C14H12O4S and molecular weight 276.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(10,10-dioxophenoxathiin-1-yl)ethanol
Also Known As: 1-Phenoxathiinethanol, 10,10-dioxide, 2-(10,10-dioxophenoxathiin-1-yl)ethanol, 2-(10,10-Dioxo-10H-10lambda*6*-phenoxathiin-1-yl)-ethanol, 1-(2-Hydroxyethyl)-10H-10lambda~6~-phenoxathiine-10,10-dione
| Molecular Formula | C14H12O4S |
|---|---|
| Molecular Weight | 276.05 g/mol |
| LogP | 2.1599 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.04562 |
| Heavy Atoms | 19 |
| Complexity | 734.8612 |
Chemical Identifiers
| CAS Number | 134476-37-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)OC3=CC=CC(=C3S2(=O)=O)CCO |
Product Overview
1-Phenoxathiinethanol, 10,10-dioxide (CAS 134476-37-2), with molecular formula C14H12O4S and molecular weight 276.05 g/mol. IUPAC: 2-(10,10-dioxophenoxathiin-1-yl)ethanol.
Chemical Property Profile of 1-Phenoxathiinethanol, 10,10-dioxide
Property Insights of 1-Phenoxathiinethanol, 10,10-dioxide
The XLogP value of 2.1599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenoxathiinethanol, 10,10-dioxide. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenoxathiinethanol, 10,10-dioxide. Following Lipinski's Rule of Five, 1-Phenoxathiinethanol, 10,10-dioxide has 1 hydrogen bond donor(s) and 4 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 1-Phenoxathiinethanol, 10,10-dioxide?
The CAS number of 1-Phenoxathiinethanol, 10,10-dioxide is 134476-37-2.
What is the molecular formula of 1-Phenoxathiinethanol, 10,10-dioxide?
The molecular formula of 1-Phenoxathiinethanol, 10,10-dioxide is C14H12O4S.
What is the molecular weight of 1-Phenoxathiinethanol, 10,10-dioxide?
The molecular weight of 1-Phenoxathiinethanol, 10,10-dioxide is 276.05 g/mol.
Where can I buy 1-Phenoxathiinethanol, 10,10-dioxide?
You can request a quote for 1-Phenoxathiinethanol, 10,10-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenoxathiinethanol, 10,10-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenoxathiinethanol, 10,10-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.