3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid
TL;DR: 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid (CAS 65865-29-4) is a chemical compound with molecular formula C8H5F3O3 and molecular weight 206.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(trifluoromethyl)furan-2-yl]prop-2-enoic acid
Also Known As: BAS 00926454, 3-[5-(trifluoromethyl)furan-2-yl]prop-2-enoic acid, 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid, 3-[5-(Trifluoromethyl)-2-furanyl]-2-propenoic acid
| Molecular Formula | C8H5F3O3 |
|---|---|
| Molecular Weight | 206.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.01907 |
| Heavy Atoms | 14 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 65865-29-4 |
|---|---|
| SMILES | C1=C(OC(=C1)C(F)(F)F)C=CC(=O)O |
| InChIKey | VPZXPSZUDWNYGT-UHFFFAOYSA-N |
Product Overview
3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid (CAS 65865-29-4), with molecular formula C8H5F3O3 and molecular weight 206.02 g/mol. IUPAC: 3-[5-(trifluoromethyl)furan-2-yl]prop-2-enoic acid.
Chemical Property Profile of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid
Property Insights of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid. With a topological polar surface area (TPSA) of 50.4 Ų, 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid has 1 hydrogen bond donor(s) and 6 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-(Trifluoromethyl)furan-2-yl)acrylic acid?
The CAS number of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid is 65865-29-4.
What is the molecular formula of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid?
The molecular formula of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid is C8H5F3O3.
What is the molecular weight of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid?
The molecular weight of 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid is 206.02 g/mol.
Where can I buy 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid?
You can request a quote for 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-(Trifluoromethyl)furan-2-yl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.