Butylamine 4-dodecylbenzenesulfonate (1:1)
TL;DR: Butylamine 4-dodecylbenzenesulfonate (1:1) (CAS 14356-36-6) is a chemical compound with molecular formula C22H41NO3S and molecular weight 399.2807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butan-1-amine;4-dodecylbenzenesulfonic acid
Also Known As: Butylamine 4-dodecylbenzenesulfonate, Butylamine 4-dodecylbenzenesulfonate (1:1), butan-1-amine; 4-dodecylbenzenesulfonic acid, 4-Dodecylbenzenesulfonic acid, butylamine salt, Benzenesulfonic acid, 4-dodecyl-, compd. with 1-butanamine (1:1)
Technical Specifications
| Molecular Formula | C22H41NO3S |
| Molecular Weight | 399.2807 g/mol |
| XLogP | 6.14 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 399.2807 Da |
| Heavy Atoms | 27 |
| Complexity | 364.0 |
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCN |
| InChIKey | PNYUCOCEZXSIBE-UHFFFAOYSA-N |
Chemical Property Profile of Butylamine 4-dodecylbenzenesulfonate (1:1)
Property Insights of Butylamine 4-dodecylbenzenesulfonate (1:1)
The XLogP value of 6.14 indicates that Butylamine 4-dodecylbenzenesulfonate (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 Butylamine 4-dodecylbenzenesulfonate (1:1). Following Lipinski's Rule of Five, Butylamine 4-dodecylbenzenesulfonate (1:1) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Butylamine 4-dodecylbenzenesulfonate (1:1)?
The CAS number of Butylamine 4-dodecylbenzenesulfonate (1:1) is 14356-36-6.
What is the molecular formula of Butylamine 4-dodecylbenzenesulfonate (1:1)?
The molecular formula of Butylamine 4-dodecylbenzenesulfonate (1:1) is C22H41NO3S.
What is the molecular weight of Butylamine 4-dodecylbenzenesulfonate (1:1)?
The molecular weight of Butylamine 4-dodecylbenzenesulfonate (1:1) is 399.2807 g/mol.
Where can I buy Butylamine 4-dodecylbenzenesulfonate (1:1)?
You can request a quote for Butylamine 4-dodecylbenzenesulfonate (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butylamine 4-dodecylbenzenesulfonate (1:1)?
Yes, CoreyChem provides custom synthesis services for Butylamine 4-dodecylbenzenesulfonate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.