己烷-1-磺酸
TL;DR: 己烷-1-磺酸 (CAS 13595-73-8) is a chemical compound with molecular formula C6H14O3S and molecular weight 166.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
己烷-1-磺酸
hexane-1-sulfonic acid
Also Known As: hexanesulfonic acid, Hexane-1-sulfonic Acid, 1-HEXANESULFONIC ACID, hexane sulfonic acid, n-hexane-1-sulfonic acid
| Molecular Formula | C6H14O3S |
|---|---|
| Molecular Weight | 166.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 166.06636 |
| Heavy Atoms | 10 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 13595-73-8 |
|---|---|
| SMILES | CCCCCCS(=O)(=O)O |
| InChIKey | FYAQQULBLMNGAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
己烷-1-磺酸 (CAS 13595-73-8), with molecular formula C6H14O3S and molecular weight 166.07 g/mol. IUPAC: hexane-1-sulfonic acid.
Chemical Property Profile of 己烷-1-磺酸
Property Insights of 己烷-1-磺酸
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 己烷-1-磺酸. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 己烷-1-磺酸. Following Lipinski's Rule of Five, 己烷-1-磺酸 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 己烷-1-磺酸?
The CAS number of 己烷-1-磺酸 is 13595-73-8.
What is the molecular formula of 己烷-1-磺酸?
The molecular formula of 己烷-1-磺酸 is C6H14O3S.
What is the molecular weight of 己烷-1-磺酸?
The molecular weight of 己烷-1-磺酸 is 166.07 g/mol.
Where can I buy 己烷-1-磺酸?
You can request a quote for 己烷-1-磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 己烷-1-磺酸?
Yes, KEHONG BIO provides custom synthesis services for 己烷-1-磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.