4-Vinylbenzyl trifluoroacetate
TL;DR: 4-Vinylbenzyl trifluoroacetate (CAS 229956-99-4) 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.
(4-ethenylphenyl)methyl 2,2,2-trifluoroacetate
Also Known As: 4-Vinylbenzyl trifluoroacetate, 4-VINYLBENZYLTRIFLUOROACETATE, mix TBC as stabilizer, (4-ethenylphenyl)methyl 2,2,2-trifluoroacetate, p-Vinyl benzyl trifluoroacetate
| Molecular Formula | C11H9F3O2 |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 2.9351 |
| 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 | 379.2113 |
Chemical Identifiers
| CAS Number | 229956-99-4 |
|---|---|
| SMILES | C=CC1=CC=C(C=C1)COC(=O)C(F)(F)F |
Product Overview
4-Vinylbenzyl trifluoroacetate (CAS 229956-99-4), with molecular formula C11H9F3O2 and molecular weight 230.06 g/mol. IUPAC: (4-ethenylphenyl)methyl 2,2,2-trifluoroacetate.
Chemical Property Profile of 4-Vinylbenzyl trifluoroacetate
Property Insights of 4-Vinylbenzyl trifluoroacetate
The XLogP value of 2.9351 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Vinylbenzyl trifluoroacetate. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Vinylbenzyl trifluoroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Vinylbenzyl trifluoroacetate 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 4-Vinylbenzyl trifluoroacetate?
The CAS number of 4-Vinylbenzyl trifluoroacetate is 229956-99-4.
What is the molecular formula of 4-Vinylbenzyl trifluoroacetate?
The molecular formula of 4-Vinylbenzyl trifluoroacetate is C11H9F3O2.
What is the molecular weight of 4-Vinylbenzyl trifluoroacetate?
The molecular weight of 4-Vinylbenzyl trifluoroacetate is 230.06 g/mol.
Where can I buy 4-Vinylbenzyl trifluoroacetate?
You can request a quote for 4-Vinylbenzyl trifluoroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Vinylbenzyl trifluoroacetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Vinylbenzyl trifluoroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.