3'-Methyl-biphenyl-3-carboxylic acid
TL;DR: 3'-Methyl-biphenyl-3-carboxylic acid (CAS 158619-46-6) is a chemical compound with molecular formula C14H12O2 and molecular weight 212.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-methylphenyl)benzoic acid
Also Known As: 3'-methylbiphenyl-3-carboxylic acid, 3-(3-methylphenyl)benzoic acid, 3'-methyl[1,1'-biphenyl]-3-carboxylic acid, 3-(m-tolyl)benzoic acid, 3'-Methyl-biphenyl-3-carboxylic acid
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H12O2 |
| Molecular Weight | 212.08372 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.08372 Da |
| Heavy Atoms | 16 |
| Complexity | 249.0 |
| SMILES | CC1=CC(=CC=C1)C2=CC(=CC=C2)C(=O)O |
| InChIKey | BJVLFJADOVATRU-UHFFFAOYSA-N |
Chemical Property Profile of 3'-Methyl-biphenyl-3-carboxylic acid
Property Insights of 3'-Methyl-biphenyl-3-carboxylic acid
The XLogP value of 4.0 indicates that 3'-Methyl-biphenyl-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3'-Methyl-biphenyl-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-Methyl-biphenyl-3-carboxylic 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'-Methyl-biphenyl-3-carboxylic acid?
The CAS number of 3'-Methyl-biphenyl-3-carboxylic acid is 158619-46-6.
What is the molecular formula of 3'-Methyl-biphenyl-3-carboxylic acid?
The molecular formula of 3'-Methyl-biphenyl-3-carboxylic acid is C14H12O2.
What is the molecular weight of 3'-Methyl-biphenyl-3-carboxylic acid?
The molecular weight of 3'-Methyl-biphenyl-3-carboxylic acid is 212.08372 g/mol.
Where can I buy 3'-Methyl-biphenyl-3-carboxylic acid?
You can request a quote for 3'-Methyl-biphenyl-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-Methyl-biphenyl-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 3'-Methyl-biphenyl-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.