3-(Pentylthio)lactic acid
TL;DR: 3-(Pentylthio)lactic acid (CAS 17606-51-8) is a chemical compound with molecular formula C8H16O3S and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3-pentylsulfanylpropanoic acid
Also Known As: 3-(Pentylthio)lactic acid, 2-hydroxy-3-pentylsulfanylpropanoic acid, 2-hydroxy-3-(pentylsulfanyl)propanoic acid, Propanoic acid, 2-hydroxy-3-(pentylthio)-, RefChem:92716
| Molecular Formula | C8H16O3S |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 82.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 192.08202 |
| Heavy Atoms | 12 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 17606-51-8 |
|---|---|
| SMILES | CCCCCSCC(C(=O)O)O |
| InChIKey | ZETBHTBLDVKNAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Pentylthio)lactic acid (CAS 17606-51-8), with molecular formula C8H16O3S and molecular weight 192.08 g/mol. IUPAC: 2-hydroxy-3-pentylsulfanylpropanoic acid.
Chemical Property Profile of 3-(Pentylthio)lactic acid
Property Insights of 3-(Pentylthio)lactic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Pentylthio)lactic acid. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Pentylthio)lactic acid. Following Lipinski's Rule of Five, 3-(Pentylthio)lactic acid has 2 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 3-(Pentylthio)lactic acid?
The CAS number of 3-(Pentylthio)lactic acid is 17606-51-8.
What is the molecular formula of 3-(Pentylthio)lactic acid?
The molecular formula of 3-(Pentylthio)lactic acid is C8H16O3S.
What is the molecular weight of 3-(Pentylthio)lactic acid?
The molecular weight of 3-(Pentylthio)lactic acid is 192.08 g/mol.
Where can I buy 3-(Pentylthio)lactic acid?
You can request a quote for 3-(Pentylthio)lactic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Pentylthio)lactic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Pentylthio)lactic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.