3-(5-甲基-2-呋喃基)丙烯酸
TL;DR: 3-(5-甲基-2-呋喃基)丙烯酸 (CAS 54160-40-6) 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.
3-(5-甲基-2-呋喃基)丙烯酸
3-(5-methylfuran-2-yl)prop-2-enoic acid
Also Known As: (2E)-3-(5-methyl-2-furyl)acrylic acid, 3-(5-methylfuran-2-yl)acrylic acid, 3-(5-Methyl-2-furanyl)-2-propenoic acid, 3-(5-methyl-2-furyl)acrylic acid, beta-(5-methyl-2-furyl) acrylic acid
| Molecular Formula | C8H8O3 |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.04735 |
| Heavy Atoms | 11 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 54160-40-6 |
|---|---|
| SMILES | CC1=CC=C(O1)C=CC(=O)O |
| InChIKey | CQCKLDAUFPKXPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(5-甲基-2-呋喃基)丙烯酸 (CAS 54160-40-6), with molecular formula C8H8O3 and molecular weight 152.05 g/mol. IUPAC: 3-(5-methylfuran-2-yl)prop-2-enoic acid.
Chemical Property Profile of 3-(5-甲基-2-呋喃基)丙烯酸
Property Insights of 3-(5-甲基-2-呋喃基)丙烯酸
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-甲基-2-呋喃基)丙烯酸. With a topological polar surface area (TPSA) of 50.4 Ų, 3-(5-甲基-2-呋喃基)丙烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-甲基-2-呋喃基)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 3-(5-甲基-2-呋喃基)丙烯酸?
The CAS number of 3-(5-甲基-2-呋喃基)丙烯酸 is 54160-40-6.
What is the molecular formula of 3-(5-甲基-2-呋喃基)丙烯酸?
The molecular formula of 3-(5-甲基-2-呋喃基)丙烯酸 is C8H8O3.
What is the molecular weight of 3-(5-甲基-2-呋喃基)丙烯酸?
The molecular weight of 3-(5-甲基-2-呋喃基)丙烯酸 is 152.05 g/mol.
Where can I buy 3-(5-甲基-2-呋喃基)丙烯酸?
You can request a quote for 3-(5-甲基-2-呋喃基)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 3-(5-甲基-2-呋喃基)丙烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-甲基-2-呋喃基)丙烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.