(3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene
TL;DR: (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene (CAS 76280-44-9) is a chemical compound with molecular formula C15H11F3 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,3,3-trifluoro-1-phenylprop-1-en-2-yl)benzene
Also Known As: 1,1-Tfmde, 1-Trifluoromethyl-1,2-diphenylethylene, (3,3,3-TRIFLUORO-1-PHENYLPROP-1-EN-2-YL)BENZENE, Benzene,1,1'-[(1E)-1-(trifluoromethyl)-1,2-ethenediyl]bis- (9CI)
| Molecular Formula | C15H11F3 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.08128 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 76280-44-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C(C2=CC=CC=C2)C(F)(F)F |
| InChIKey | RTSUHIVNLKAOKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene (CAS 76280-44-9), with molecular formula C15H11F3 and molecular weight 248.08 g/mol. IUPAC: (3,3,3-trifluoro-1-phenylprop-1-en-2-yl)benzene.
Chemical Property Profile of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene
Property Insights of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene
The XLogP value of 5.3 indicates that (3,3,3-Trifluoro-1-phenylprop-1-EN-2-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-1-phenylprop-1-EN-2-YL)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene?
The CAS number of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene is 76280-44-9.
What is the molecular formula of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene?
The molecular formula of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene is C15H11F3.
What is the molecular weight of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene?
The molecular weight of (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene is 248.08 g/mol.
Where can I buy (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene?
You can request a quote for (3,3,3-Trifluoro-1-phenylprop-1-EN-2-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-1-phenylprop-1-EN-2-YL)benzene?
Yes, KEHONG BIO provides custom synthesis services for (3,3,3-Trifluoro-1-phenylprop-1-EN-2-YL)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.