3-(Octylamino)propane-1-sulfonic acid
TL;DR: 3-(Octylamino)propane-1-sulfonic acid (CAS 1119-95-5) is a chemical compound with molecular formula C11H25NO3S and molecular weight 251.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(octylamino)propane-1-sulfonic acid
Also Known As: 3-(octylamino)propane-1-sulfonic Acid
| Molecular Formula | C11H25NO3S |
|---|---|
| Molecular Weight | 251.16 g/mol |
| LogP | 2.2144 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 251.15552 |
| Heavy Atoms | 16 |
| Complexity | 239.61423 |
Chemical Identifiers
| CAS Number | 1119-95-5 |
|---|---|
| SMILES | CCCCCCCCNCCCS(=O)(=O)O |
Product Overview
3-(Octylamino)propane-1-sulfonic acid (CAS 1119-95-5), with molecular formula C11H25NO3S and molecular weight 251.16 g/mol. IUPAC: 3-(octylamino)propane-1-sulfonic acid.
Chemical Property Profile of 3-(Octylamino)propane-1-sulfonic acid
Property Insights of 3-(Octylamino)propane-1-sulfonic acid
The XLogP value of 2.2144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Octylamino)propane-1-sulfonic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Octylamino)propane-1-sulfonic acid. Following Lipinski's Rule of Five, 3-(Octylamino)propane-1-sulfonic 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 3-(Octylamino)propane-1-sulfonic acid?
The CAS number of 3-(Octylamino)propane-1-sulfonic acid is 1119-95-5.
What is the molecular formula of 3-(Octylamino)propane-1-sulfonic acid?
The molecular formula of 3-(Octylamino)propane-1-sulfonic acid is C11H25NO3S.
What is the molecular weight of 3-(Octylamino)propane-1-sulfonic acid?
The molecular weight of 3-(Octylamino)propane-1-sulfonic acid is 251.16 g/mol.
Where can I buy 3-(Octylamino)propane-1-sulfonic acid?
You can request a quote for 3-(Octylamino)propane-1-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Octylamino)propane-1-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Octylamino)propane-1-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.