4-十二烷-6-基苯磺酸
TL;DR: 4-十二烷-6-基苯磺酸 (CAS 23003-92-1) 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.
4-十二烷-6-基苯磺酸
4-dodecan-6-ylbenzenesulfonic acid
Also Known As: Alkylbenzene sulfonate, 4-dodecan-6-ylbenzenesulfonic Acid, 6-(p-sulfophenyl) dodecane, 4-(dodecan-6-yl)benzenesulfonic acid, 4-(1-Hexylhexyl)benzenesulfonic acid
| Molecular Formula | C18H30O3S |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 326.19156 |
| Heavy Atoms | 22 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 23003-92-1 |
|---|---|
| SMILES | CCCCCCC(CCCCC)C1=CC=C(C=C1)S(=O)(=O)O |
| InChIKey | GHNRTXCRBJQVGN-UHFFFAOYSA-N |
Product Overview
4-十二烷-6-基苯磺酸 (CAS 23003-92-1), with molecular formula C18H30O3S and molecular weight 326.19 g/mol. IUPAC: 4-dodecan-6-ylbenzenesulfonic acid.
Chemical Property Profile of 4-十二烷-6-基苯磺酸
Property Insights of 4-十二烷-6-基苯磺酸
The XLogP value of 6.7 indicates that 4-十二烷-6-基苯磺酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-十二烷-6-基苯磺酸. Following Lipinski's Rule of Five, 4-十二烷-6-基苯磺酸 has 1 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 4-十二烷-6-基苯磺酸?
The CAS number of 4-十二烷-6-基苯磺酸 is 23003-92-1.
What is the molecular formula of 4-十二烷-6-基苯磺酸?
The molecular formula of 4-十二烷-6-基苯磺酸 is C18H30O3S.
What is the molecular weight of 4-十二烷-6-基苯磺酸?
The molecular weight of 4-十二烷-6-基苯磺酸 is 326.19 g/mol.
Where can I buy 4-十二烷-6-基苯磺酸?
You can request a quote for 4-十二烷-6-基苯磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-十二烷-6-基苯磺酸?
Yes, KEHONG BIO provides custom synthesis services for 4-十二烷-6-基苯磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.