3-(Trifluoromethyl)styrene
TL;DR: 3-(Trifluoromethyl)styrene (CAS 384-64-5) is a chemical compound with molecular formula C9H7F3 and molecular weight 172.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethenyl-3-(trifluoromethyl)benzene
Also Known As: 3-(Trifluoromethyl)styrene, 1-(trifluoromethyl)-3-vinylbenzene, 1-ethenyl-3-(trifluoromethyl)benzene, 3- styrene, 3-Vinylbenzotrifluoride
| Molecular Formula | C9H7F3 |
|---|---|
| Molecular Weight | 172.05 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.04999 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 384-64-5 |
|---|---|
| SMILES | C=CC1=CC(=CC=C1)C(F)(F)F |
| InChIKey | ARHOUOIHKWELMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Trifluoromethyl)styrene (CAS 384-64-5), with molecular formula C9H7F3 and molecular weight 172.05 g/mol. IUPAC: 1-ethenyl-3-(trifluoromethyl)benzene.
Chemical Property Profile of 3-(Trifluoromethyl)styrene
Property Insights of 3-(Trifluoromethyl)styrene
The XLogP value of 3.7 indicates that 3-(Trifluoromethyl)styrene 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-(Trifluoromethyl)styrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethyl)styrene has 0 hydrogen bond donor(s) and 3 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)styrene?
The CAS number of 3-(Trifluoromethyl)styrene is 384-64-5.
What is the molecular formula of 3-(Trifluoromethyl)styrene?
The molecular formula of 3-(Trifluoromethyl)styrene is C9H7F3.
What is the molecular weight of 3-(Trifluoromethyl)styrene?
The molecular weight of 3-(Trifluoromethyl)styrene is 172.05 g/mol.
Where can I buy 3-(Trifluoromethyl)styrene?
You can request a quote for 3-(Trifluoromethyl)styrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Trifluoromethyl)styrene?
Yes, KEHONG BIO provides custom synthesis services for 3-(Trifluoromethyl)styrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.