2-Methoxycinnamic acid
TL;DR: 2-Methoxycinnamic acid (CAS 22955-75-5) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2-methoxyphenyl)prop-2-enoic acid
Also Known As: 2-Methoxycinnamic acid, trans-2-Methoxycinnamic acid, 3-(2-Methoxyphenyl)acrylic acid, o-Methoxycinnamic acid, (E)-3-(2-Methoxyphenyl)acrylic acid
| Molecular Formula | C10H10O3 |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.06299 |
| Heavy Atoms | 13 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 22955-75-5 |
|---|---|
| SMILES | COC1=CC=CC=C1/C=C/C(=O)O |
| InChIKey | FEGVSPGUHMGGBO-VOTSOKGWSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxycinnamic acid (CAS 22955-75-5), with molecular formula C10H10O3 and molecular weight 178.06 g/mol. IUPAC: (E)-3-(2-methoxyphenyl)prop-2-enoic acid.
Chemical Property Profile of 2-Methoxycinnamic acid
Property Insights of 2-Methoxycinnamic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxycinnamic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Methoxycinnamic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxycinnamic 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 2-Methoxycinnamic acid?
The CAS number of 2-Methoxycinnamic acid is 22955-75-5.
What is the molecular formula of 2-Methoxycinnamic acid?
The molecular formula of 2-Methoxycinnamic acid is C10H10O3.
What is the molecular weight of 2-Methoxycinnamic acid?
The molecular weight of 2-Methoxycinnamic acid is 178.06 g/mol.
Where can I buy 2-Methoxycinnamic acid?
You can request a quote for 2-Methoxycinnamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxycinnamic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxycinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.