3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid
TL;DR: 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid (CAS 4389-71-3) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methyl-5-propan-2-ylphenyl)propanoic acid
Also Known As: 3-(2-methyl-5-propan-2-ylphenyl)propanoic acid, 3-(2-methyl-5-propan-2-yl-phenyl)propanoic Acid, 3-(5-isopropyl-2-methylphenyl)propanoic acid (en)p-Cymene-2-
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 3.13562 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 353.55362 |
Chemical Identifiers
| CAS Number | 4389-71-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(C)C)CCC(=O)O |
Product Overview
3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid (CAS 4389-71-3), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 3-(2-methyl-5-propan-2-ylphenyl)propanoic acid.
Chemical Property Profile of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid
Property Insights of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid
The XLogP value of 3.13562 indicates that 3-(2-Methyl-5-propan-2-ylphenyl)propanoic 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-(2-Methyl-5-propan-2-ylphenyl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methyl-5-propan-2-ylphenyl)propanoic 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 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid?
The CAS number of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid is 4389-71-3.
What is the molecular formula of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid?
The molecular formula of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid is C13H18O2.
What is the molecular weight of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid?
The molecular weight of 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid is 206.13 g/mol.
Where can I buy 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid?
You can request a quote for 3-(2-Methyl-5-propan-2-ylphenyl)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-(2-Methyl-5-propan-2-ylphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methyl-5-propan-2-ylphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.