![(E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid structure](/static/products/7221/72210-18-5.webp)
(E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid
TL;DR: (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid (CAS 72210-18-5) is a chemical compound with molecular formula C9H6F3NO2 and molecular weight 217.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[6-(trifluoromethyl)-3-pyridinyl]prop-2-enoic acid
Also Known As: (E)-3-(6-(Trifluoromethyl)pyridin-3-yl)acrylic acid, (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid, (2E)-3-[6-(Trifluoromethyl)pyridin-3-yl]propenoic acid, 3-(6-Trifluoromethyl-3-pyridinyl)-2-propenoic acid, (2E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic acid
| Molecular Formula | C9H6F3NO2 |
|---|---|
| Molecular Weight | 217.04 g/mol |
| LogP | 2.1982 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.03506 |
| Heavy Atoms | 15 |
| Complexity | 381.33908 |
Chemical Identifiers
| CAS Number | 72210-18-5 |
|---|---|
| SMILES | C1=CC(=NC=C1C=CC(=O)O)C(F)(F)F |
Product Overview
(E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid (CAS 72210-18-5), with molecular formula C9H6F3NO2 and molecular weight 217.04 g/mol. IUPAC: 3-[6-(trifluoromethyl)-3-pyridinyl]prop-2-enoic acid.
Chemical Property Profile of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid
Property Insights of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid
The XLogP value of 2.1982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid. With a topological polar surface area (TPSA) of 50.19 Ų, (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid has 1 hydrogen bond donor(s) and 2 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 (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid?
The CAS number of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid is 72210-18-5.
What is the molecular formula of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid?
The molecular formula of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid is C9H6F3NO2.
What is the molecular weight of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid?
The molecular weight of (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid is 217.04 g/mol.
Where can I buy (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid?
You can request a quote for (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-[6-(trifluoromethyl)pyridin-3-yl]prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.