cis-Acetylacrylic acid
TL;DR: cis-Acetylacrylic acid (CAS 2833-21-8) is a chemical compound with molecular formula C5H6O3 and molecular weight 114.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-oxopent-2-enoic acid
Also Known As: cis-Acetylacrylate, cis-acetylacrylic acid, Acetylacrylic acid, (Z)-acetylacrylic acid, (Z)-4-oxopent-2-enoic acid
| Molecular Formula | C5H6O3 |
|---|---|
| Molecular Weight | 114.03 g/mol |
| LogP | 0.2162 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 114.03169 |
| Heavy Atoms | 8 |
| Complexity | 118.60921 |
Chemical Identifiers
| CAS Number | 2833-21-8 |
|---|---|
| SMILES | CC(=O)/C=C\C(=O)O |
Product Overview
cis-Acetylacrylic acid (CAS 2833-21-8), with molecular formula C5H6O3 and molecular weight 114.03 g/mol. IUPAC: (Z)-4-oxopent-2-enoic acid.
Chemical Property Profile of cis-Acetylacrylic acid
Property Insights of cis-Acetylacrylic acid
The XLogP value of 0.2162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-Acetylacrylic acid. With a topological polar surface area (TPSA) of 54.37 Ų, cis-Acetylacrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-Acetylacrylic acid has 1 hydrogen bond donor(s) and 2 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 cis-Acetylacrylic acid?
The CAS number of cis-Acetylacrylic acid is 2833-21-8.
What is the molecular formula of cis-Acetylacrylic acid?
The molecular formula of cis-Acetylacrylic acid is C5H6O3.
What is the molecular weight of cis-Acetylacrylic acid?
The molecular weight of cis-Acetylacrylic acid is 114.03 g/mol.
Where can I buy cis-Acetylacrylic acid?
You can request a quote for cis-Acetylacrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-Acetylacrylic acid?
Yes, KEHONG BIO provides custom synthesis services for cis-Acetylacrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.