Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)
TL;DR: Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) (CAS 68259-35-8) is a chemical compound with molecular formula C20H37NO3S and molecular weight 371.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-amine;2-undecylbenzenesulfonic acid
Also Known As: Isopropylammonium undecylbenzenesulfonate, Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1), propan-2-amine; 2-undecylbenzenesulfonic acid, Undecylbenzenesulphonic acid, compound with isopropylamine (1:1), 2-Undecylbenzene-1-sulfonic acid--propan-2-amine (1/1)
| Molecular Formula | C20H37NO3S |
|---|---|
| Molecular Weight | 371.25 g/mol |
| LogP | 5.3601 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 371.24942 |
| Heavy Atoms | 25 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 68259-35-8 |
|---|---|
| SMILES | CCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CC(C)N |
| InChIKey | HSSVTQFPPQWKIG-UHFFFAOYSA-N |
Product Overview
Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) (CAS 68259-35-8), with molecular formula C20H37NO3S and molecular weight 371.25 g/mol. IUPAC: propan-2-amine;2-undecylbenzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)
Property Insights of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)
The XLogP value of 5.3601 indicates that Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1). Following Lipinski's Rule of Five, Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)?
The CAS number of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) is 68259-35-8.
What is the molecular formula of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)?
The molecular formula of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) is C20H37NO3S.
What is the molecular weight of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)?
The molecular weight of Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) is 371.25 g/mol.
Where can I buy Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)?
You can request a quote for Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, undecyl-, compd. with 2-propanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.