3,3'-Bis(trifluoromethyl)benzophenone
TL;DR: 3,3'-Bis(trifluoromethyl)benzophenone (CAS 74901-29-4) is a chemical compound with molecular formula C15H8F6O and molecular weight 318.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[3-(trifluoromethyl)phenyl]methanone
Also Known As: 3,3'-Bis(trifluoromethyl)benzophenone, bis(3-(trifluoromethyl)phenyl)methanone, Bis[3-(trifluoromethyl)phenyl]methanone, 3,3'-di(Trifluoromethyl)benzophenone, 3-formyl-4-hydroxybenzonitrile
| Molecular Formula | C15H8F6O |
|---|---|
| Molecular Weight | 318.05 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.04794 |
| Heavy Atoms | 22 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 74901-29-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)C2=CC(=CC=C2)C(F)(F)F |
| InChIKey | POOXOHISLGOAEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Bis(trifluoromethyl)benzophenone (CAS 74901-29-4), with molecular formula C15H8F6O and molecular weight 318.05 g/mol. IUPAC: bis[3-(trifluoromethyl)phenyl]methanone.
Chemical Property Profile of 3,3'-Bis(trifluoromethyl)benzophenone
Property Insights of 3,3'-Bis(trifluoromethyl)benzophenone
The XLogP value of 5.0 indicates that 3,3'-Bis(trifluoromethyl)benzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3,3'-Bis(trifluoromethyl)benzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Bis(trifluoromethyl)benzophenone has 0 hydrogen bond donor(s) and 7 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'-Bis(trifluoromethyl)benzophenone?
The CAS number of 3,3'-Bis(trifluoromethyl)benzophenone is 74901-29-4.
What is the molecular formula of 3,3'-Bis(trifluoromethyl)benzophenone?
The molecular formula of 3,3'-Bis(trifluoromethyl)benzophenone is C15H8F6O.
What is the molecular weight of 3,3'-Bis(trifluoromethyl)benzophenone?
The molecular weight of 3,3'-Bis(trifluoromethyl)benzophenone is 318.05 g/mol.
Where can I buy 3,3'-Bis(trifluoromethyl)benzophenone?
You can request a quote for 3,3'-Bis(trifluoromethyl)benzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Bis(trifluoromethyl)benzophenone?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Bis(trifluoromethyl)benzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.