O-METHOXY-alpha-METHYLCINNAMIC ACID
TL;DR: O-METHOXY-alpha-METHYLCINNAMIC ACID (CAS 3368-15-8) 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-(2-methoxyphenyl)-2-methylprop-2-enoic acid
Also Known As: O-METHOXY-alpha-METHYLCINNAMIC ACID, 3-(2-methoxyphenyl)-2-methylprop-2-enoic acid, 2-Propenoic acid, 3-(2-methoxyphenyl)-2-methyl-, (E)-3-(2-methoxyphenyl)-2-methylprop-2-enoic acid
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 2.5 |
| 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 | 233.0 |
Chemical Identifiers
| CAS Number | 3368-15-8 |
|---|---|
| SMILES | CC(=CC1=CC=CC=C1OC)C(=O)O |
| InChIKey | JKCOQORKEFKVAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O-METHOXY-alpha-METHYLCINNAMIC ACID (CAS 3368-15-8), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 3-(2-methoxyphenyl)-2-methylprop-2-enoic acid.
Chemical Property Profile of O-METHOXY-alpha-METHYLCINNAMIC ACID
Property Insights of O-METHOXY-alpha-METHYLCINNAMIC ACID
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-METHOXY-alpha-METHYLCINNAMIC ACID. With a topological polar surface area (TPSA) of 46.5 Ų, O-METHOXY-alpha-METHYLCINNAMIC ACID exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-METHOXY-alpha-METHYLCINNAMIC 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 O-METHOXY-alpha-METHYLCINNAMIC ACID?
The CAS number of O-METHOXY-alpha-METHYLCINNAMIC ACID is 3368-15-8.
What is the molecular formula of O-METHOXY-alpha-METHYLCINNAMIC ACID?
The molecular formula of O-METHOXY-alpha-METHYLCINNAMIC ACID is C11H12O3.
What is the molecular weight of O-METHOXY-alpha-METHYLCINNAMIC ACID?
The molecular weight of O-METHOXY-alpha-METHYLCINNAMIC ACID is 192.08 g/mol.
Where can I buy O-METHOXY-alpha-METHYLCINNAMIC ACID?
You can request a quote for O-METHOXY-alpha-METHYLCINNAMIC ACID directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-METHOXY-alpha-METHYLCINNAMIC ACID?
Yes, KEHONG BIO provides custom synthesis services for O-METHOXY-alpha-METHYLCINNAMIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.