4'-Methyl-biphenyl-3-carboxylic acid
TL;DR: 4'-Methyl-biphenyl-3-carboxylic acid (CAS 54842-56-7) is a chemical compound with molecular formula C14H12O2 and molecular weight 212.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)benzoic acid
Also Known As: 4'-Methylbiphenyl-3-carboxylic acid, 4'-Methyl-[1,1'-biphenyl]-3-carboxylic acid, 3-(4-methylphenyl)benzoic Acid, 4'-Methyl-biphenyl-3-carboxylic acid, 3-(p-Tolyl)benzoic acid
| Molecular Formula | C14H12O2 |
|---|---|
| Molecular Weight | 212.08 g/mol |
| LogP | 3.36022 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.08372 |
| Heavy Atoms | 16 |
| Complexity | 512.5135 |
Chemical Identifiers
| CAS Number | 54842-56-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O |
Product Overview
4'-Methyl-biphenyl-3-carboxylic acid (CAS 54842-56-7), with molecular formula C14H12O2 and molecular weight 212.08 g/mol. IUPAC: 3-(4-methylphenyl)benzoic acid.
Chemical Property Profile of 4'-Methyl-biphenyl-3-carboxylic acid
Property Insights of 4'-Methyl-biphenyl-3-carboxylic acid
The XLogP value of 3.36022 indicates that 4'-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, 4'-Methyl-biphenyl-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Methyl-biphenyl-3-carboxylic acid has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-Methyl-biphenyl-3-carboxylic acid?
The CAS number of 4'-Methyl-biphenyl-3-carboxylic acid is 54842-56-7.
What is the molecular formula of 4'-Methyl-biphenyl-3-carboxylic acid?
The molecular formula of 4'-Methyl-biphenyl-3-carboxylic acid is C14H12O2.
What is the molecular weight of 4'-Methyl-biphenyl-3-carboxylic acid?
The molecular weight of 4'-Methyl-biphenyl-3-carboxylic acid is 212.08 g/mol.
Where can I buy 4'-Methyl-biphenyl-3-carboxylic acid?
You can request a quote for 4'-Methyl-biphenyl-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Methyl-biphenyl-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4'-Methyl-biphenyl-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.