![[3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene structure](/static/products/418/41879-17-8.png)
[3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene
TL;DR: [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene (CAS 41879-17-8) is a chemical compound with molecular formula C10H6F6 and molecular weight 240.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,3,3-trifluoro-2-(trifluoromethyl)prop-1-enyl]benzene
Also Known As: bis(trifluoromethyl)phenylethylene, beta,beta-Bis(trifluoromethyl)styrene, [3,3,3-trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene, [3,3,3-trifluoro-2-(trifluoromethyl)prop-1-enyl]benzene, 1-Phenyl-2-(trifluoromethyl)-3,3,3-trifluoro-1-propene
| Molecular Formula | C10H6F6 |
|---|---|
| Molecular Weight | 240.04 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.03737 |
| Heavy Atoms | 16 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 41879-17-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C(C(F)(F)F)C(F)(F)F |
| InChIKey | CLMJLXXZFCOQRB-UHFFFAOYSA-N |
Product Overview
[3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene (CAS 41879-17-8), with molecular formula C10H6F6 and molecular weight 240.04 g/mol. IUPAC: [3,3,3-trifluoro-2-(trifluoromethyl)prop-1-enyl]benzene.
Chemical Property Profile of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene
Property Insights of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene
The XLogP value of 4.6 indicates that [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene has 0 hydrogen bond donor(s) and 6 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-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene?
The CAS number of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene is 41879-17-8.
What is the molecular formula of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene?
The molecular formula of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene is C10H6F6.
What is the molecular weight of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene?
The molecular weight of [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene is 240.04 g/mol.
Where can I buy [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene?
You can request a quote for [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene 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-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene?
Yes, KEHONG BIO provides custom synthesis services for [3,3,3-Trifluoro-2-(trifluoromethyl)prop-1-en-1-yl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.