6-Sulfanylhexanoic acid
TL;DR: 6-Sulfanylhexanoic acid (CAS 17689-17-7) is a chemical compound with molecular formula C6H12O2S and molecular weight 148.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-sulfanylhexanoic acid
Also Known As: 6-Mercaptohexanoic acid, 6-sulfanylhexanoic acid, Hexanoic acid, 6-mercapto-, 5-carboxy-1-pentanethiol, 6-Mercaptohexanoicacid
| Molecular Formula | C6H12O2S |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 148.0558 |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 17689-17-7 |
|---|---|
| SMILES | C(CCC(=O)O)CCS |
| InChIKey | CMNQZZPAVNBESS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Sulfanylhexanoic acid (CAS 17689-17-7), with molecular formula C6H12O2S and molecular weight 148.06 g/mol. IUPAC: 6-sulfanylhexanoic acid.
Chemical Property Profile of 6-Sulfanylhexanoic acid
Property Insights of 6-Sulfanylhexanoic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Sulfanylhexanoic acid. With a topological polar surface area (TPSA) of 38.3 Ų, 6-Sulfanylhexanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Sulfanylhexanoic acid has 2 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 6-Sulfanylhexanoic acid?
The CAS number of 6-Sulfanylhexanoic acid is 17689-17-7.
What is the molecular formula of 6-Sulfanylhexanoic acid?
The molecular formula of 6-Sulfanylhexanoic acid is C6H12O2S.
What is the molecular weight of 6-Sulfanylhexanoic acid?
The molecular weight of 6-Sulfanylhexanoic acid is 148.06 g/mol.
Where can I buy 6-Sulfanylhexanoic acid?
You can request a quote for 6-Sulfanylhexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Sulfanylhexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Sulfanylhexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.