4-羟基丁-2-烯酸
TL;DR: 4-羟基丁-2-烯酸 (CAS 951894-06-7) 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.
4-羟基丁-2-烯酸
4-hydroxybut-2-enoic acid
Also Known As: 4-Hydroxycrotonic acid, 4-hydroxybut-2-enoic acid, (E)-4-hydroxybut-2-enoic acid, gamma-Hydroxycrotonic acid, trans-4-hydroxycrotonic acid
| Molecular Formula | C4H6O3 |
|---|---|
| Molecular Weight | 102.03 g/mol |
| LogP | -0.6 |
| 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 | 84.0 |
Chemical Identifiers
| CAS Number | 951894-06-7 |
|---|---|
| SMILES | C(C=CC(=O)O)O |
| InChIKey | RMQJECWPWQIIPW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-羟基丁-2-烯酸 (CAS 951894-06-7), with molecular formula C4H6O3 and molecular weight 102.03 g/mol. IUPAC: 4-hydroxybut-2-enoic acid.
Chemical Property Profile of 4-羟基丁-2-烯酸
Property Insights of 4-羟基丁-2-烯酸
The XLogP value of -0.6 indicates that 4-羟基丁-2-烯酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.5 Ų, 4-羟基丁-2-烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-羟基丁-2-烯酸 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-羟基丁-2-烯酸?
The CAS number of 4-羟基丁-2-烯酸 is 951894-06-7.
What is the molecular formula of 4-羟基丁-2-烯酸?
The molecular formula of 4-羟基丁-2-烯酸 is C4H6O3.
What is the molecular weight of 4-羟基丁-2-烯酸?
The molecular weight of 4-羟基丁-2-烯酸 is 102.03 g/mol.
Where can I buy 4-羟基丁-2-烯酸?
You can request a quote for 4-羟基丁-2-烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-羟基丁-2-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 4-羟基丁-2-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.