3-(Dodecylsulfonyl)propanoic acid
TL;DR: 3-(Dodecylsulfonyl)propanoic acid (CAS 101453-22-9) is a chemical compound with molecular formula C15H30O4S and molecular weight 306.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-dodecylsulfonylpropanoic acid
Also Known As: 3-(Dodecylsulfonyl)propanoic acid, 3-dodecylsulfonylpropanoic acid, 3-(dodecylsulfonyl) propanoic acid, 3-(Dodecane-1-sulfonyl)-propionic acid
| Molecular Formula | C15H30O4S |
|---|---|
| Molecular Weight | 306.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 306.1865 |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 101453-22-9 |
|---|---|
| SMILES | CCCCCCCCCCCCS(=O)(=O)CCC(=O)O |
| InChIKey | BYSJGTIFJVSZIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Dodecylsulfonyl)propanoic acid (CAS 101453-22-9), with molecular formula C15H30O4S and molecular weight 306.19 g/mol. IUPAC: 3-dodecylsulfonylpropanoic acid.
Chemical Property Profile of 3-(Dodecylsulfonyl)propanoic acid
Property Insights of 3-(Dodecylsulfonyl)propanoic acid
The XLogP value of 4.7 indicates that 3-(Dodecylsulfonyl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Dodecylsulfonyl)propanoic acid. Following Lipinski's Rule of Five, 3-(Dodecylsulfonyl)propanoic 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 3-(Dodecylsulfonyl)propanoic acid?
The CAS number of 3-(Dodecylsulfonyl)propanoic acid is 101453-22-9.
What is the molecular formula of 3-(Dodecylsulfonyl)propanoic acid?
The molecular formula of 3-(Dodecylsulfonyl)propanoic acid is C15H30O4S.
What is the molecular weight of 3-(Dodecylsulfonyl)propanoic acid?
The molecular weight of 3-(Dodecylsulfonyl)propanoic acid is 306.19 g/mol.
Where can I buy 3-(Dodecylsulfonyl)propanoic acid?
You can request a quote for 3-(Dodecylsulfonyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dodecylsulfonyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dodecylsulfonyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.