3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid
TL;DR: 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid (CAS 33130-03-9) is a chemical compound with molecular formula C12H14O5 and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid
Also Known As: 2,3,4-Trimethoxycinnamic acid, trans-2,3,4-Trimethoxycinnamic acid, 2,3,4-TrimethoxycinnamicAcid, 3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid, 2-Propenoic acid,3-(2,3,4-trimethoxyphenyl)-
| Molecular Formula | C12H14O5 |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.08412 |
| Heavy Atoms | 17 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 33130-03-9 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C=CC(=O)O)OC)OC |
| InChIKey | ZYOPDNLIHHFGEC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid (CAS 33130-03-9), with molecular formula C12H14O5 and molecular weight 238.08 g/mol. IUPAC: 3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid
Property Insights of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid. Following Lipinski's Rule of Five, 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid has 1 hydrogen bond donor(s) and 5 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-(2,3,4-Trimethoxyphenyl)-2-propenoic acid?
The CAS number of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid is 33130-03-9.
What is the molecular formula of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid?
The molecular formula of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid is C12H14O5.
What is the molecular weight of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid?
The molecular weight of 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid is 238.08 g/mol.
Where can I buy 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid?
You can request a quote for 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3,4-Trimethoxyphenyl)-2-propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.