1-(p-Tolyl)cyclopropanecarboxylic acid
TL;DR: 1-(p-Tolyl)cyclopropanecarboxylic acid (CAS 83846-66-6) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylphenyl)cyclopropane-1-carboxylic acid
Also Known As: 1-(p-Tolyl)cyclopropanecarboxylic acid, 1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid, 1-(4-methylphenyl)cyclopropanecarboxylic acid, 1-(4-methylphenyl)cyclopropane-1-carboxylic acid, 1-p-tolylcyclopropanecarboxylic acid
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H12O2 |
| Molecular Weight | 176.08372 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.08372 Da |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
| SMILES | CC1=CC=C(C=C1)C2(CC2)C(=O)O |
| InChIKey | AYUGAOYMYXSOKU-UHFFFAOYSA-N |
Chemical Property Profile of 1-(p-Tolyl)cyclopropanecarboxylic acid
Property Insights of 1-(p-Tolyl)cyclopropanecarboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(p-Tolyl)cyclopropanecarboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 1-(p-Tolyl)cyclopropanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(p-Tolyl)cyclopropanecarboxylic acid has 1 hydrogen bond donor(s) and 2 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-(p-Tolyl)cyclopropanecarboxylic acid?
The CAS number of 1-(p-Tolyl)cyclopropanecarboxylic acid is 83846-66-6.
What is the molecular formula of 1-(p-Tolyl)cyclopropanecarboxylic acid?
The molecular formula of 1-(p-Tolyl)cyclopropanecarboxylic acid is C11H12O2.
What is the molecular weight of 1-(p-Tolyl)cyclopropanecarboxylic acid?
The molecular weight of 1-(p-Tolyl)cyclopropanecarboxylic acid is 176.08372 g/mol.
Where can I buy 1-(p-Tolyl)cyclopropanecarboxylic acid?
You can request a quote for 1-(p-Tolyl)cyclopropanecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(p-Tolyl)cyclopropanecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-(p-Tolyl)cyclopropanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.