3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one
TL;DR: 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one (CAS 354538-62-8) is a chemical compound with molecular formula C10H10O2S and molecular weight 194.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-5-thiophen-2-ylcyclohex-2-en-1-one
Also Known As: 3-hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one, 3-hydroxy-5-thiophen-2-ylcyclohex-2-en-1-one, 3-hydroxy-5-(thiophen-2-yl)cyclohex-2-enone, 3-hydroxy-5-(2-thienyl)-2-cyclohexen-1-one, 2-Cyclohexen-1-one, 3-hydroxy-5-(2-thienyl)-
| Molecular Formula | C10H10O2S |
|---|---|
| Molecular Weight | 194.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.04015 |
| Heavy Atoms | 13 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 354538-62-8 |
|---|---|
| SMILES | C1C(CC(=O)C=C1O)C2=CC=CS2 |
| InChIKey | FLXYAARDDKWMSF-UHFFFAOYSA-N |
Product Overview
3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one (CAS 354538-62-8), with molecular formula C10H10O2S and molecular weight 194.04 g/mol. IUPAC: 3-hydroxy-5-thiophen-2-ylcyclohex-2-en-1-one.
Chemical Property Profile of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one
Property Insights of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one. Following Lipinski's Rule of Five, 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one has 1 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 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one?
The CAS number of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one is 354538-62-8.
What is the molecular formula of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one?
The molecular formula of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one is C10H10O2S.
What is the molecular weight of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one?
The molecular weight of 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one is 194.04 g/mol.
Where can I buy 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one?
You can request a quote for 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-5-(thiophen-2-yl)cyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.