![5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one structure](/static/products/2296/22963-97-9.webp)
5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one
TL;DR: 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one (CAS 22963-97-9) is a chemical compound with molecular formula C7H14O2S and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-hydroxyethylsulfanyl)pentan-2-one
Also Known As: 3-Methylmercapto-cyclohexanon, 5-(2-hydroxyethylsulfanyl)pentan-2-one, 5-[(2-hydroxyethyl)sulfanyl]pentan-2-one, 2-Pentanone,5-[(2-hydroxyethyl)thio]-
| Molecular Formula | C7H14O2S |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 162.07146 |
| Heavy Atoms | 10 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 22963-97-9 |
|---|---|
| SMILES | CC(=O)CCCSCCO |
| InChIKey | XLLIIEOPMUFPPP-UHFFFAOYSA-N |
Product Overview
5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one (CAS 22963-97-9), with molecular formula C7H14O2S and molecular weight 162.07 g/mol. IUPAC: 5-(2-hydroxyethylsulfanyl)pentan-2-one.
Chemical Property Profile of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one
Property Insights of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one. Following Lipinski's Rule of Five, 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-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 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one?
The CAS number of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one is 22963-97-9.
What is the molecular formula of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one?
The molecular formula of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one is C7H14O2S.
What is the molecular weight of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one?
The molecular weight of 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one is 162.07 g/mol.
Where can I buy 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one?
You can request a quote for 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Hydroxyethyl)sulfanyl]pentan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.