3-(Dodecylamino)-1-propanesulfonic acid
TL;DR: 3-(Dodecylamino)-1-propanesulfonic acid (CAS 1120-00-9) is a chemical compound with molecular formula C15H33NO3S and molecular weight 307.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dodecylamino)propane-1-sulfonic acid
Also Known As: Dcdfe-nac, 3-(dodecylamino)propane-1-sulfonic acid, 3-Dodecylaminopropanesulfonic acid, 3-(Dodecylamino)-1-propanesulfonic acid, 4-Azonia-hexadecan-1-sulfonat
| Molecular Formula | C15H33NO3S |
|---|---|
| Molecular Weight | 307.22 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 307.2181 |
| Heavy Atoms | 20 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 1120-00-9 |
|---|---|
| SMILES | CCCCCCCCCCCCNCCCS(=O)(=O)O |
| InChIKey | ONDJNAKJCWJYSX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Dodecylamino)-1-propanesulfonic acid (CAS 1120-00-9), with molecular formula C15H33NO3S and molecular weight 307.22 g/mol. IUPAC: 3-(dodecylamino)propane-1-sulfonic acid.
Chemical Property Profile of 3-(Dodecylamino)-1-propanesulfonic acid
Property Insights of 3-(Dodecylamino)-1-propanesulfonic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Dodecylamino)-1-propanesulfonic acid. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Dodecylamino)-1-propanesulfonic acid. Following Lipinski's Rule of Five, 3-(Dodecylamino)-1-propanesulfonic acid has 2 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-(Dodecylamino)-1-propanesulfonic acid?
The CAS number of 3-(Dodecylamino)-1-propanesulfonic acid is 1120-00-9.
What is the molecular formula of 3-(Dodecylamino)-1-propanesulfonic acid?
The molecular formula of 3-(Dodecylamino)-1-propanesulfonic acid is C15H33NO3S.
What is the molecular weight of 3-(Dodecylamino)-1-propanesulfonic acid?
The molecular weight of 3-(Dodecylamino)-1-propanesulfonic acid is 307.22 g/mol.
Where can I buy 3-(Dodecylamino)-1-propanesulfonic acid?
You can request a quote for 3-(Dodecylamino)-1-propanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dodecylamino)-1-propanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dodecylamino)-1-propanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.