4-(10-Methylundecyl)benzenesulfonic acid
TL;DR: 4-(10-Methylundecyl)benzenesulfonic acid (CAS 68411-32-5) 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-(10-methylundecyl)benzenesulfonic acid
Also Known As: C12 Branched alkylbenzenesulfonic acid, 4-(10-methylundecyl)benzenesulfonic acid, Benzenesulfonic acid, dodecyl-, branched, 4-(10-Methylundecyl)benzene-1-sulfonic 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 | 362.0 |
Chemical Identifiers
| CAS Number | 68411-32-5 |
|---|---|
| SMILES | CC(C)CCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O |
| InChIKey | NLIZZNXFRGDAMS-UHFFFAOYSA-N |
Product Overview
4-(10-Methylundecyl)benzenesulfonic acid (CAS 68411-32-5), with molecular formula C18H30O3S and molecular weight 326.19 g/mol. IUPAC: 4-(10-methylundecyl)benzenesulfonic acid.
Chemical Property Profile of 4-(10-Methylundecyl)benzenesulfonic acid
Property Insights of 4-(10-Methylundecyl)benzenesulfonic acid
The XLogP value of 6.7 indicates that 4-(10-Methylundecyl)benzenesulfonic acid 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-(10-Methylundecyl)benzenesulfonic acid. Following Lipinski's Rule of Five, 4-(10-Methylundecyl)benzenesulfonic acid 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-(10-Methylundecyl)benzenesulfonic acid?
The CAS number of 4-(10-Methylundecyl)benzenesulfonic acid is 68411-32-5.
What is the molecular formula of 4-(10-Methylundecyl)benzenesulfonic acid?
The molecular formula of 4-(10-Methylundecyl)benzenesulfonic acid is C18H30O3S.
What is the molecular weight of 4-(10-Methylundecyl)benzenesulfonic acid?
The molecular weight of 4-(10-Methylundecyl)benzenesulfonic acid is 326.19 g/mol.
Where can I buy 4-(10-Methylundecyl)benzenesulfonic acid?
You can request a quote for 4-(10-Methylundecyl)benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(10-Methylundecyl)benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(10-Methylundecyl)benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.