3-(3,4-dimethylphenyl)propanoic Acid
TL;DR: 3-(3,4-dimethylphenyl)propanoic Acid (CAS 1094463-26-9) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-dimethylphenyl)propanoic acid
Also Known As: 3-(3,4-dimethylphenyl)propanoic Acid, 3-(3,4-DIMETHYLPHENYL)PROPIONIC ACID, Benzenepropanoic acid, 3,4-dimethyl-, 3,4-Dimethylbenzenepropanoic acid, 1-Chloro-2,4-difluorobenzene
Technical Specifications
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.09938 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.09938 Da |
| Heavy Atoms | 13 |
| Complexity | 177.0 |
| SMILES | CC1=C(C=C(C=C1)CCC(=O)O)C |
| InChIKey | FHEOAGCWJWUKJJ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3,4-dimethylphenyl)propanoic Acid
Property Insights of 3-(3,4-dimethylphenyl)propanoic Acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-dimethylphenyl)propanoic Acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(3,4-dimethylphenyl)propanoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-dimethylphenyl)propanoic 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 3-(3,4-dimethylphenyl)propanoic Acid?
The CAS number of 3-(3,4-dimethylphenyl)propanoic Acid is 1094463-26-9.
What is the molecular formula of 3-(3,4-dimethylphenyl)propanoic Acid?
The molecular formula of 3-(3,4-dimethylphenyl)propanoic Acid is C11H14O2.
What is the molecular weight of 3-(3,4-dimethylphenyl)propanoic Acid?
The molecular weight of 3-(3,4-dimethylphenyl)propanoic Acid is 178.09938 g/mol.
Where can I buy 3-(3,4-dimethylphenyl)propanoic Acid?
You can request a quote for 3-(3,4-dimethylphenyl)propanoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3,4-dimethylphenyl)propanoic Acid?
Yes, CoreyChem provides custom synthesis services for 3-(3,4-dimethylphenyl)propanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.