Benzene, 1,3-bis(trifluoromethyl)-
TL;DR: Benzene, 1,3-bis(trifluoromethyl)- (CAS 14389-12-9) is a chemical compound with molecular formula C8H4F6 and molecular weight 214.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(trifluoromethyl)benzene
Also Known As: 1,3-Bis(trifluoromethyl)benzene, Benzene, 1,3-bis(trifluoromethyl)-, Hexafluoro-m-xylene, 1,3-Bis(trifluoromethyl)-benzene, m-ditrifluorotoluene
| Molecular Formula | C8H4F6 |
|---|---|
| Molecular Weight | 214.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.02171 |
| Heavy Atoms | 14 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 14389-12-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
| InChIKey | SJBBXFLOLUTGCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,3-bis(trifluoromethyl)- (CAS 14389-12-9), with molecular formula C8H4F6 and molecular weight 214.02 g/mol. IUPAC: 1,3-bis(trifluoromethyl)benzene.
Chemical Property Profile of Benzene, 1,3-bis(trifluoromethyl)-
Property Insights of Benzene, 1,3-bis(trifluoromethyl)-
The XLogP value of 3.8 indicates that Benzene, 1,3-bis(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1,3-bis(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,3-bis(trifluoromethyl)- 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 Benzene, 1,3-bis(trifluoromethyl)-?
The CAS number of Benzene, 1,3-bis(trifluoromethyl)- is 14389-12-9.
What is the molecular formula of Benzene, 1,3-bis(trifluoromethyl)-?
The molecular formula of Benzene, 1,3-bis(trifluoromethyl)- is C8H4F6.
What is the molecular weight of Benzene, 1,3-bis(trifluoromethyl)-?
The molecular weight of Benzene, 1,3-bis(trifluoromethyl)- is 214.02 g/mol.
Where can I buy Benzene, 1,3-bis(trifluoromethyl)-?
You can request a quote for Benzene, 1,3-bis(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,3-bis(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,3-bis(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.