三氟乙烯基苯
TL;DR: 三氟乙烯基苯 (CAS 447-14-3) is a chemical compound with molecular formula C8H5F3 and molecular weight 158.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三氟乙烯基苯
1,2,2-trifluoroethenylbenzene
Also Known As: Trifluorostyrene, (Trifluorovinyl)benzene, (Trifluoroethenyl)benzene, Benzene, (trifluoroethenyl)-, 1',2',2'-Trifluorostyrene
| Molecular Formula | C8H5F3 |
|---|---|
| Molecular Weight | 158.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.03433 |
| Heavy Atoms | 11 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 447-14-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=C(F)F)F |
| InChIKey | SUTQSIHGGHVXFK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三氟乙烯基苯 (CAS 447-14-3), with molecular formula C8H5F3 and molecular weight 158.03 g/mol. IUPAC: 1,2,2-trifluoroethenylbenzene.
Chemical Property Profile of 三氟乙烯基苯
Property Insights of 三氟乙烯基苯
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三氟乙烯基苯. With a topological polar surface area (TPSA) of 0.0 Ų, 三氟乙烯基苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三氟乙烯基苯 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 三氟乙烯基苯?
The CAS number of 三氟乙烯基苯 is 447-14-3.
What is the molecular formula of 三氟乙烯基苯?
The molecular formula of 三氟乙烯基苯 is C8H5F3.
What is the molecular weight of 三氟乙烯基苯?
The molecular weight of 三氟乙烯基苯 is 158.03 g/mol.
Where can I buy 三氟乙烯基苯?
You can request a quote for 三氟乙烯基苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三氟乙烯基苯?
Yes, KEHONG BIO provides custom synthesis services for 三氟乙烯基苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.