11-(Acetylsulfanyl)undecanoic acid
TL;DR: 11-(Acetylsulfanyl)undecanoic acid (CAS 89985-53-5) is a chemical compound with molecular formula C13H24O3S and molecular weight 260.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-acetylsulfanylundecanoic acid
Also Known As: 11-(acetylsulfanyl)undecanoic acid, 11-acetylthioundecanoic acid, Undecanoic acid,11-(acetylthio)-, 11-(Acetylthio)undecanoic acid, 11-acetylsulfanylundecanoic acid
| Molecular Formula | C13H24O3S |
|---|---|
| Molecular Weight | 260.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 260.14462 |
| Heavy Atoms | 17 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 89985-53-5 |
|---|---|
| SMILES | CC(=O)SCCCCCCCCCCC(=O)O |
| InChIKey | DHKWYRRJFXRZOA-UHFFFAOYSA-N |
Product Overview
11-(Acetylsulfanyl)undecanoic acid (CAS 89985-53-5), with molecular formula C13H24O3S and molecular weight 260.14 g/mol. IUPAC: 11-acetylsulfanylundecanoic acid.
Chemical Property Profile of 11-(Acetylsulfanyl)undecanoic acid
Property Insights of 11-(Acetylsulfanyl)undecanoic acid
The XLogP value of 3.9 indicates that 11-(Acetylsulfanyl)undecanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-(Acetylsulfanyl)undecanoic acid. Following Lipinski's Rule of Five, 11-(Acetylsulfanyl)undecanoic acid has 1 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 11-(Acetylsulfanyl)undecanoic acid?
The CAS number of 11-(Acetylsulfanyl)undecanoic acid is 89985-53-5.
What is the molecular formula of 11-(Acetylsulfanyl)undecanoic acid?
The molecular formula of 11-(Acetylsulfanyl)undecanoic acid is C13H24O3S.
What is the molecular weight of 11-(Acetylsulfanyl)undecanoic acid?
The molecular weight of 11-(Acetylsulfanyl)undecanoic acid is 260.14 g/mol.
Where can I buy 11-(Acetylsulfanyl)undecanoic acid?
You can request a quote for 11-(Acetylsulfanyl)undecanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-(Acetylsulfanyl)undecanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 11-(Acetylsulfanyl)undecanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.