4-(2-呋喃基)丁-2-烯酸
TL;DR: 4-(2-呋喃基)丁-2-烯酸 (CAS 69766-42-3) is a chemical compound with molecular formula C8H8O3 and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-呋喃基)丁-2-烯酸
4-(furan-2-yl)but-2-enoic acid
Also Known As: 3-FURFURACRYLIC ACID, 4-(furan-2-yl)but-2-enoic acid, (E)-4-(furan-2-yl)but-2-enoic acid
| Molecular Formula | C8H8O3 |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 152.04735 |
| Heavy Atoms | 11 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 69766-42-3 |
|---|---|
| SMILES | C1=COC(=C1)CC=CC(=O)O |
| InChIKey | JKZFRKHYUVIIFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-呋喃基)丁-2-烯酸 (CAS 69766-42-3), with molecular formula C8H8O3 and molecular weight 152.05 g/mol. IUPAC: 4-(furan-2-yl)but-2-enoic acid.
Chemical Property Profile of 4-(2-呋喃基)丁-2-烯酸
Property Insights of 4-(2-呋喃基)丁-2-烯酸
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-呋喃基)丁-2-烯酸. With a topological polar surface area (TPSA) of 50.4 Ų, 4-(2-呋喃基)丁-2-烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-呋喃基)丁-2-烯酸 has 1 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-(2-呋喃基)丁-2-烯酸?
The CAS number of 4-(2-呋喃基)丁-2-烯酸 is 69766-42-3.
What is the molecular formula of 4-(2-呋喃基)丁-2-烯酸?
The molecular formula of 4-(2-呋喃基)丁-2-烯酸 is C8H8O3.
What is the molecular weight of 4-(2-呋喃基)丁-2-烯酸?
The molecular weight of 4-(2-呋喃基)丁-2-烯酸 is 152.05 g/mol.
Where can I buy 4-(2-呋喃基)丁-2-烯酸?
You can request a quote for 4-(2-呋喃基)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-(2-呋喃基)丁-2-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-呋喃基)丁-2-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.