2-Hydroxybut-3-enoic acid
TL;DR: 2-Hydroxybut-3-enoic acid (CAS 96243-34-4) is a chemical compound with molecular formula C4H6O3 and molecular weight 102.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxybut-3-enoic acid
Also Known As: 2-hydroxybut-3-enoic acid, Vinylglycolic acid, Vinylglykolsaure, 2-Hydroxy-3-butenoic acid, 2-Hydroxy-3-butenoicacid
| Molecular Formula | C4H6O3 |
|---|---|
| Molecular Weight | 102.03 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.03169 |
| Heavy Atoms | 7 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 96243-34-4 |
|---|---|
| SMILES | C=CC(C(=O)O)O |
| InChIKey | VBWPSWWDYVWZKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxybut-3-enoic acid (CAS 96243-34-4), with molecular formula C4H6O3 and molecular weight 102.03 g/mol. IUPAC: 2-hydroxybut-3-enoic acid.
Chemical Property Profile of 2-Hydroxybut-3-enoic acid
Property Insights of 2-Hydroxybut-3-enoic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxybut-3-enoic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 2-Hydroxybut-3-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxybut-3-enoic 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 2-Hydroxybut-3-enoic acid?
The CAS number of 2-Hydroxybut-3-enoic acid is 96243-34-4.
What is the molecular formula of 2-Hydroxybut-3-enoic acid?
The molecular formula of 2-Hydroxybut-3-enoic acid is C4H6O3.
What is the molecular weight of 2-Hydroxybut-3-enoic acid?
The molecular weight of 2-Hydroxybut-3-enoic acid is 102.03 g/mol.
Where can I buy 2-Hydroxybut-3-enoic acid?
You can request a quote for 2-Hydroxybut-3-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxybut-3-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxybut-3-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.