3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid
TL;DR: 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid (CAS 158664-75-6) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid
Also Known As: 3-hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid, 3-Hydroxy-2-methyl-3-(p-tolyl)propanoic acid, 2-methyl-3-hydroxy-3-(4'-methylphenyl)propionic acid
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 1.74912 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 315.80945 |
Chemical Identifiers
| CAS Number | 158664-75-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C(C)C(=O)O)O |
Product Overview
3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid (CAS 158664-75-6), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: 3-hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid.
Chemical Property Profile of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid
Property Insights of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid
The XLogP value of 1.74912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid. With a topological polar surface area (TPSA) of 57.53 Ų, 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid has 2 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 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid?
The CAS number of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid is 158664-75-6.
What is the molecular formula of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid?
The molecular formula of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid is C11H14O3.
What is the molecular weight of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid?
The molecular weight of 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid is 194.09 g/mol.
Where can I buy 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid?
You can request a quote for 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2-methyl-3-(4-methylphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.