![Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- structure](/static/products/6780/67801-04-1.webp)
Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-
TL;DR: Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- (CAS 67801-04-1) is a chemical compound with molecular formula C16H19NO3S and molecular weight 305.10855 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(N-ethyl-3-methylanilino)methyl]benzenesulfonic acid
Also Known As: Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-, 4-[[Ethyl(3-methylphenyl)amino]methyl]benzenesulfonic acid, 4-[(N-ethyl-3-methylanilino)methyl]benzenesulfonic acid, Benzenesulfonic acid, 4-((ethyl(3-methylphenyl)amino)methyl)-, 4-((Ethyl(3-methylphenyl)amino)methyl)benzenesulfonic acid
Technical Specifications
| Molecular Formula | C16H19NO3S |
| Molecular Weight | 305.10855 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.10855 Da |
| Heavy Atoms | 21 |
| Complexity | 410.0 |
| SMILES | CCN(CC1=CC=C(C=C1)S(=O)(=O)O)C2=CC=CC(=C2)C |
| InChIKey | GEGYISULLZOCOD-UHFFFAOYSA-N |
Chemical Property Profile of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-
Property Insights of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-
The XLogP value of 3.0 indicates that Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-. Following Lipinski's Rule of Five, Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-?
The CAS number of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- is 67801-04-1.
What is the molecular formula of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-?
The molecular formula of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- is C16H19NO3S.
What is the molecular weight of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-?
The molecular weight of Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- is 305.10855 g/mol.
Where can I buy Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-?
You can request a quote for Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]-?
Yes, CoreyChem provides custom synthesis services for Benzenesulfonic acid, 4-[[ethyl(3-methylphenyl)amino]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.