4-Acetylaminocinnamic acid
TL;DR: 4-Acetylaminocinnamic acid (CAS 67249-02-9) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-acetamidophenyl)prop-2-enoic acid
Also Known As: 4-ACETAMIDOCINNAMIC ACID, N,N-Dimethylacrylamide, 4-acetylaminocinnamic acid, 3-[4-(acetylamino)phenyl]acrylic acid, 3-(4-acetamidophenyl)acrylic acid
| Molecular Formula | C11H11NO3 |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.0739 |
| Heavy Atoms | 15 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 67249-02-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C=CC(=O)O |
| InChIKey | WGMFHSADKZJPGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Acetylaminocinnamic acid (CAS 67249-02-9), with molecular formula C11H11NO3 and molecular weight 205.07 g/mol. IUPAC: 3-(4-acetamidophenyl)prop-2-enoic acid.
Chemical Property Profile of 4-Acetylaminocinnamic acid
Property Insights of 4-Acetylaminocinnamic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetylaminocinnamic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetylaminocinnamic acid. Following Lipinski's Rule of Five, 4-Acetylaminocinnamic acid has 2 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 4-Acetylaminocinnamic acid?
The CAS number of 4-Acetylaminocinnamic acid is 67249-02-9.
What is the molecular formula of 4-Acetylaminocinnamic acid?
The molecular formula of 4-Acetylaminocinnamic acid is C11H11NO3.
What is the molecular weight of 4-Acetylaminocinnamic acid?
The molecular weight of 4-Acetylaminocinnamic acid is 205.07 g/mol.
Where can I buy 4-Acetylaminocinnamic acid?
You can request a quote for 4-Acetylaminocinnamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetylaminocinnamic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetylaminocinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.