3-(4-Methoxyphenyl)-2-methylacrylic acid
TL;DR: 3-(4-Methoxyphenyl)-2-methylacrylic acid (CAS 40527-52-4) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-2-methylprop-2-enoic acid
Also Known As: 3-(4-methoxyphenyl)-2-methylacrylic acid, 4-METHOXY-ALPHA-METHYLCINNAMIC ACID, 3-(4-methoxyphenyl)-2-methyl-prop-2-enoic acid, 3-(4-methoxyphenyl)-2-methylprop-2-enoic acid, 2-Propenoic acid, 3-(4-methoxyphenyl)-2-methyl-
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 40527-52-4 |
|---|---|
| SMILES | CC(=CC1=CC=C(C=C1)OC)C(=O)O |
| InChIKey | SVHHFLSABYBJTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Methoxyphenyl)-2-methylacrylic acid (CAS 40527-52-4), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 3-(4-methoxyphenyl)-2-methylprop-2-enoic acid.
Chemical Property Profile of 3-(4-Methoxyphenyl)-2-methylacrylic acid
Property Insights of 3-(4-Methoxyphenyl)-2-methylacrylic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methoxyphenyl)-2-methylacrylic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 3-(4-Methoxyphenyl)-2-methylacrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methoxyphenyl)-2-methylacrylic acid has 1 hydrogen bond donor(s) and 3 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-(4-Methoxyphenyl)-2-methylacrylic acid?
The CAS number of 3-(4-Methoxyphenyl)-2-methylacrylic acid is 40527-52-4.
What is the molecular formula of 3-(4-Methoxyphenyl)-2-methylacrylic acid?
The molecular formula of 3-(4-Methoxyphenyl)-2-methylacrylic acid is C11H12O3.
What is the molecular weight of 3-(4-Methoxyphenyl)-2-methylacrylic acid?
The molecular weight of 3-(4-Methoxyphenyl)-2-methylacrylic acid is 192.08 g/mol.
Where can I buy 3-(4-Methoxyphenyl)-2-methylacrylic acid?
You can request a quote for 3-(4-Methoxyphenyl)-2-methylacrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methoxyphenyl)-2-methylacrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methoxyphenyl)-2-methylacrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.