十二烷基苯磺酸酯
TL;DR: 十二烷基苯磺酸酯 (CAS 1886-81-3) is a chemical compound with molecular formula C18H30O3S and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
十二烷基苯磺酸酯
dodecyl benzenesulfonate
Also Known As: DODECYL BENZENESULFONATE, Dodecyl benzenesulphonate, Dodecylbenzenesulfonate, dodecylbenzene sulfonate, n-dodecylbenzenesulfonate
| Molecular Formula | C18H30O3S |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 326.19156 |
| Heavy Atoms | 22 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 1886-81-3 |
|---|---|
| SMILES | CCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1 |
| InChIKey | YRIUSKIDOIARQF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
十二烷基苯磺酸酯 (CAS 1886-81-3), with molecular formula C18H30O3S and molecular weight 326.19 g/mol. IUPAC: dodecyl benzenesulfonate.
Chemical Property Profile of 十二烷基苯磺酸酯
Property Insights of 十二烷基苯磺酸酯
The XLogP value of 6.8 indicates that 十二烷基苯磺酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 十二烷基苯磺酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 十二烷基苯磺酸酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 十二烷基苯磺酸酯?
The CAS number of 十二烷基苯磺酸酯 is 1886-81-3.
What is the molecular formula of 十二烷基苯磺酸酯?
The molecular formula of 十二烷基苯磺酸酯 is C18H30O3S.
What is the molecular weight of 十二烷基苯磺酸酯?
The molecular weight of 十二烷基苯磺酸酯 is 326.19 g/mol.
Where can I buy 十二烷基苯磺酸酯?
You can request a quote for 十二烷基苯磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 十二烷基苯磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for 十二烷基苯磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.