2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol
TL;DR: 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol (CAS 175203-70-0) is a chemical compound with molecular formula C10H11NO5S2 and molecular weight 289.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-nitro-1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)sulfanyl]ethanol
Also Known As: Maybridge1_005013, BUTTPARK 95\04-04, 2-[(6-NITRO-1,1-DIOXIDO-2,3-DIHYDRO-1-BENZOTHIEN-3-YL)THIO]ETHANOL, 2-[(6-nitro-1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)sulfanyl]ethanol, I14-35028
| Molecular Formula | C10H11NO5S2 |
|---|---|
| Molecular Weight | 289.01 g/mol |
| LogP | 1.1487 |
| Topological Polar Surface Area | 97.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.00787 |
| Heavy Atoms | 18 |
| Complexity | 583.93085 |
Chemical Identifiers
| CAS Number | 175203-70-0 |
|---|---|
| SMILES | C1C(C2=C(S1(=O)=O)C=C(C=C2)[N+](=O)[O-])SCCO |
Product Overview
2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol (CAS 175203-70-0), with molecular formula C10H11NO5S2 and molecular weight 289.01 g/mol. IUPAC: 2-[(6-nitro-1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)sulfanyl]ethanol.
Chemical Property Profile of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol
Property Insights of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol
The XLogP value of 1.1487 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol. The TPSA of 97.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol. Following Lipinski's Rule of Five, 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol has 1 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-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol?
The CAS number of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol is 175203-70-0.
What is the molecular formula of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol?
The molecular formula of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol is C10H11NO5S2.
What is the molecular weight of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol?
The molecular weight of 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol is 289.01 g/mol.
Where can I buy 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol?
You can request a quote for 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-Nitro-1,1-dioxido-2,3-dihydro-1-benzothien-3-YL)thio]ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.