3-(Trifluoromethyl)benzyl methacrylate
TL;DR: 3-(Trifluoromethyl)benzyl methacrylate (CAS 231630-83-4) is a chemical compound with molecular formula C12H11F3O2 and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(trifluoromethyl)phenyl]methyl 2-methylprop-2-enoate
Also Known As: 3-(Trifluoromethyl)benzyl methacrylate, [3-(trifluoromethyl)phenyl]methyl 2-methylprop-2-enoate
| Molecular Formula | C12H11F3O2 |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 3.3247 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.07112 |
| Heavy Atoms | 17 |
| Complexity | 435.62204 |
Chemical Identifiers
| CAS Number | 231630-83-4 |
|---|---|
| SMILES | CC(=C)C(=O)OCC1=CC(=CC=C1)C(F)(F)F |
Product Overview
3-(Trifluoromethyl)benzyl methacrylate (CAS 231630-83-4), with molecular formula C12H11F3O2 and molecular weight 244.07 g/mol. IUPAC: [3-(trifluoromethyl)phenyl]methyl 2-methylprop-2-enoate.
Chemical Property Profile of 3-(Trifluoromethyl)benzyl methacrylate
Property Insights of 3-(Trifluoromethyl)benzyl methacrylate
The XLogP value of 3.3247 indicates that 3-(Trifluoromethyl)benzyl methacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(Trifluoromethyl)benzyl methacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethyl)benzyl methacrylate 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 methacrylate?
The CAS number of 3-(Trifluoromethyl)benzyl methacrylate is 231630-83-4.
What is the molecular formula of 3-(Trifluoromethyl)benzyl methacrylate?
The molecular formula of 3-(Trifluoromethyl)benzyl methacrylate is C12H11F3O2.
What is the molecular weight of 3-(Trifluoromethyl)benzyl methacrylate?
The molecular weight of 3-(Trifluoromethyl)benzyl methacrylate is 244.07 g/mol.
Where can I buy 3-(Trifluoromethyl)benzyl methacrylate?
You can request a quote for 3-(Trifluoromethyl)benzyl methacrylate 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 methacrylate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Trifluoromethyl)benzyl methacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.