(2E)-3-(呋喃-3-基)丙烯酸
TL;DR: (2E)-3-(呋喃-3-基)丙烯酸 (CAS 81311-95-7) is a chemical compound with molecular formula C7H6O3 and molecular weight 138.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-3-(呋喃-3-基)丙烯酸
(E)-3-(furan-3-yl)prop-2-enoic acid
Also Known As: 3-(3-Furyl)acrylic acid, 3-(Furan-3-yl)acrylic acid, trans-3-Furanacrylic acid, (e)-3-(furan-3-yl)acrylic acid, furan-3-acrylic acid
| Molecular Formula | C7H6O3 |
|---|---|
| Molecular Weight | 138.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 138.0317 |
| Heavy Atoms | 10 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 81311-95-7 |
|---|---|
| SMILES | C1=COC=C1/C=C/C(=O)O |
| InChIKey | JHAPZUDWRRBZHZ-OWOJBTEDSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2E)-3-(呋喃-3-基)丙烯酸 (CAS 81311-95-7), with molecular formula C7H6O3 and molecular weight 138.03 g/mol. IUPAC: (E)-3-(furan-3-yl)prop-2-enoic acid.
Chemical Property Profile of (2E)-3-(呋喃-3-基)丙烯酸
Property Insights of (2E)-3-(呋喃-3-基)丙烯酸
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(呋喃-3-基)丙烯酸. With a topological polar surface area (TPSA) of 50.4 Ų, (2E)-3-(呋喃-3-基)丙烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(呋喃-3-基)丙烯酸 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 (2E)-3-(呋喃-3-基)丙烯酸?
The CAS number of (2E)-3-(呋喃-3-基)丙烯酸 is 81311-95-7.
What is the molecular formula of (2E)-3-(呋喃-3-基)丙烯酸?
The molecular formula of (2E)-3-(呋喃-3-基)丙烯酸 is C7H6O3.
What is the molecular weight of (2E)-3-(呋喃-3-基)丙烯酸?
The molecular weight of (2E)-3-(呋喃-3-基)丙烯酸 is 138.03 g/mol.
Where can I buy (2E)-3-(呋喃-3-基)丙烯酸?
You can request a quote for (2E)-3-(呋喃-3-基)丙烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(呋喃-3-基)丙烯酸?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(呋喃-3-基)丙烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.