3-(Trifluoromethyl)benzyl acrylate
TL;DR: 3-(Trifluoromethyl)benzyl acrylate (CAS 144261-45-0) is a chemical compound with molecular formula C11H9F3O2 and molecular weight 230.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(trifluoromethyl)phenyl]methyl prop-2-enoate
Also Known As: 3-(Trifluoromethyl)benzyl acrylate, [3-(trifluoromethyl)phenyl]methyl Prop-2-enoate, 3-(trifluoromethyl)phenylmethyl acrylate
| Molecular Formula | C11H9F3O2 |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 2.9346 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.05547 |
| Heavy Atoms | 16 |
| Complexity | 396.4613 |
Chemical Identifiers
| CAS Number | 144261-45-0 |
|---|---|
| SMILES | C=CC(=O)OCC1=CC(=CC=C1)C(F)(F)F |
Product Overview
3-(Trifluoromethyl)benzyl acrylate (CAS 144261-45-0), with molecular formula C11H9F3O2 and molecular weight 230.06 g/mol. IUPAC: [3-(trifluoromethyl)phenyl]methyl prop-2-enoate.
Chemical Property Profile of 3-(Trifluoromethyl)benzyl acrylate
Property Insights of 3-(Trifluoromethyl)benzyl acrylate
The XLogP value of 2.9346 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Trifluoromethyl)benzyl acrylate. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(Trifluoromethyl)benzyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethyl)benzyl acrylate has 0 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 3-(Trifluoromethyl)benzyl acrylate?
The CAS number of 3-(Trifluoromethyl)benzyl acrylate is 144261-45-0.
What is the molecular formula of 3-(Trifluoromethyl)benzyl acrylate?
The molecular formula of 3-(Trifluoromethyl)benzyl acrylate is C11H9F3O2.
What is the molecular weight of 3-(Trifluoromethyl)benzyl acrylate?
The molecular weight of 3-(Trifluoromethyl)benzyl acrylate is 230.06 g/mol.
Where can I buy 3-(Trifluoromethyl)benzyl acrylate?
You can request a quote for 3-(Trifluoromethyl)benzyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Trifluoromethyl)benzyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Trifluoromethyl)benzyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.