1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid
TL;DR: 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid (CAS 134937-38-5) is a chemical compound with molecular formula C13H16O4S and molecular weight 268.07693 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylphenyl)sulfonylcyclopentane-1-carboxylic acid
Also Known As: 1-(4-methylbenzenesulfonyl)cyclopentane-1-carboxylic acid, 1-[(4-methylphenyl)sulfonyl]cyclopentanecarboxylic acid, 1-(4-methylphenyl)sulfonylcyclopentane-1-carboxylic Acid, 1-(p-tolylsulfonyl)cyclopentanecarboxylic acid, 1-(4-methylbenzenesulfonyl)cyclopentane-1-carboxylicacid
Technical Specifications
| Molecular Formula | C13H16O4S |
| Molecular Weight | 268.07693 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.07693 Da |
| Heavy Atoms | 18 |
| Complexity | 407.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2(CCCC2)C(=O)O |
| InChIKey | FBXBJKJVRNXBNJ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid
Property Insights of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid. Following Lipinski's Rule of Five, 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid 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 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid?
The CAS number of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid is 134937-38-5.
What is the molecular formula of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid?
The molecular formula of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid is C13H16O4S.
What is the molecular weight of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid?
The molecular weight of 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid is 268.07693 g/mol.
Where can I buy 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid?
You can request a quote for 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-(4-Methylbenzenesulfonyl)cyclopentane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.