4-(4-sulfophenyl)benzoic Acid
TL;DR: 4-(4-sulfophenyl)benzoic Acid (CAS 114879-31-1) is a chemical compound with molecular formula C13H10O5S and molecular weight 278.0249 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-sulfophenyl)benzoic acid
Also Known As: 4-(4-sulfophenyl)benzoic Acid, [1,1'-Biphenyl]-4-carboxylicacid, 4'-sulfo-, 4'-sulfo-biphenyl-4-carboxylic acid, 4'-Sulfo-biphenyl-carbonsaeure-(4), [1,1'-Biphenyl]-4-carboxylic acid, 4'-sulfo-
Technical Specifications
| Molecular Formula | C13H10O5S |
| Molecular Weight | 278.0249 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0249 Da |
| Heavy Atoms | 19 |
| Complexity | 409.0 |
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)C(=O)O |
| InChIKey | PWULGFUNKQJPNG-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-sulfophenyl)benzoic Acid
Property Insights of 4-(4-sulfophenyl)benzoic Acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-sulfophenyl)benzoic Acid. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-sulfophenyl)benzoic Acid. Following Lipinski's Rule of Five, 4-(4-sulfophenyl)benzoic Acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(4-sulfophenyl)benzoic Acid?
The CAS number of 4-(4-sulfophenyl)benzoic Acid is 114879-31-1.
What is the molecular formula of 4-(4-sulfophenyl)benzoic Acid?
The molecular formula of 4-(4-sulfophenyl)benzoic Acid is C13H10O5S.
What is the molecular weight of 4-(4-sulfophenyl)benzoic Acid?
The molecular weight of 4-(4-sulfophenyl)benzoic Acid is 278.0249 g/mol.
Where can I buy 4-(4-sulfophenyl)benzoic Acid?
You can request a quote for 4-(4-sulfophenyl)benzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-sulfophenyl)benzoic Acid?
Yes, CoreyChem provides custom synthesis services for 4-(4-sulfophenyl)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.