3,3,3-Trifluoropropyl 2-methylprop-2-enoate
TL;DR: 3,3,3-Trifluoropropyl 2-methylprop-2-enoate (CAS 73666-77-0) is a chemical compound with molecular formula C7H9F3O2 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,3-trifluoropropyl 2-methylprop-2-enoate
Also Known As: 2-(Perfluoroalkyl)ethyl methacrylate, 3,3,3-trifluoropropyl 2-methylprop-2-enoate, Benzeneacetic acid,a,a'-thiobis, 2-Methyl-3-(methyldithio)furan, (C-F2)mult-C6-H9-F-O2
| Molecular Formula | C7H9F3O2 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 182.05547 |
| Heavy Atoms | 12 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 73666-77-0 |
|---|---|
| SMILES | CC(=C)C(=O)OCCC(F)(F)F |
| InChIKey | DCEGHEFYVNDALO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3,3-Trifluoropropyl 2-methylprop-2-enoate (CAS 73666-77-0), with molecular formula C7H9F3O2 and molecular weight 182.06 g/mol. IUPAC: 3,3,3-trifluoropropyl 2-methylprop-2-enoate.
Chemical Property Profile of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate
Property Insights of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate
The XLogP value of 3.1 indicates that 3,3,3-Trifluoropropyl 2-methylprop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3,3,3-Trifluoropropyl 2-methylprop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,3-Trifluoropropyl 2-methylprop-2-enoate has 0 hydrogen bond donor(s) and 5 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 3,3,3-Trifluoropropyl 2-methylprop-2-enoate?
The CAS number of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate is 73666-77-0.
What is the molecular formula of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate?
The molecular formula of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate is C7H9F3O2.
What is the molecular weight of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate?
The molecular weight of 3,3,3-Trifluoropropyl 2-methylprop-2-enoate is 182.06 g/mol.
Where can I buy 3,3,3-Trifluoropropyl 2-methylprop-2-enoate?
You can request a quote for 3,3,3-Trifluoropropyl 2-methylprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,3-Trifluoropropyl 2-methylprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 3,3,3-Trifluoropropyl 2-methylprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.