(1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester
TL;DR: (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester (CAS 114772-34-8) is a chemical compound with molecular formula C15H14O2 and molecular weight 226.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-methylphenyl)benzoate
Also Known As: Methyl 2-(p-Tolyl)benzoate, 4'-Methylbiphenyl-2-carboxylic acid methyl ester, Methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate, Methyl 4'-Methylbiphenyl-2-carboxylate, Methyl 2-(4-Methylphenyl)benzoate
| Molecular Formula | C15H14O2 |
|---|---|
| Molecular Weight | 226.10 g/mol |
| LogP | 3.44862 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.09938 |
| Heavy Atoms | 17 |
| Complexity | 526.873 |
Chemical Identifiers
| CAS Number | 114772-34-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC |
Product Overview
(1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester (CAS 114772-34-8), with molecular formula C15H14O2 and molecular weight 226.10 g/mol. IUPAC: methyl 2-(4-methylphenyl)benzoate.
Chemical Property Profile of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester
Property Insights of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester
The XLogP value of 3.44862 indicates that (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester has 0 hydrogen bond donor(s) and 2 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 (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester?
The CAS number of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester is 114772-34-8.
What is the molecular formula of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester?
The molecular formula of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester is C15H14O2.
What is the molecular weight of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester?
The molecular weight of (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester is 226.10 g/mol.
Where can I buy (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester?
You can request a quote for (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for (1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.