3',4',5'-Trifluoroacetophenone
TL;DR: 3',4',5'-Trifluoroacetophenone (CAS 220141-73-1) is a chemical compound with molecular formula C8H5F3O and molecular weight 174.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4,5-trifluorophenyl)ethanone
Also Known As: 3',4',5'-Trifluoroacetophenone, 1-(3,4,5-trifluorophenyl)ethanone, 3,4,5-trifluoroacetophenone, 1-(3,4,5-trifluorophenyl)ethan-1-one, 3,4,5-triflouroacetophenone
| Molecular Formula | C8H5F3O |
|---|---|
| Molecular Weight | 174.03 g/mol |
| LogP | 2.3065 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.02925 |
| Heavy Atoms | 12 |
| Complexity | 310.07 |
Chemical Identifiers
| CAS Number | 220141-73-1 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C(=C1)F)F)F |
Product Overview
3',4',5'-Trifluoroacetophenone (CAS 220141-73-1), with molecular formula C8H5F3O and molecular weight 174.03 g/mol. IUPAC: 1-(3,4,5-trifluorophenyl)ethanone.
Chemical Property Profile of 3',4',5'-Trifluoroacetophenone
Property Insights of 3',4',5'-Trifluoroacetophenone
The XLogP value of 2.3065 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',4',5'-Trifluoroacetophenone. With a topological polar surface area (TPSA) of 17.07 Ų, 3',4',5'-Trifluoroacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3',4',5'-Trifluoroacetophenone has 0 hydrogen bond donor(s) and 1 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',4',5'-Trifluoroacetophenone?
The CAS number of 3',4',5'-Trifluoroacetophenone is 220141-73-1.
What is the molecular formula of 3',4',5'-Trifluoroacetophenone?
The molecular formula of 3',4',5'-Trifluoroacetophenone is C8H5F3O.
What is the molecular weight of 3',4',5'-Trifluoroacetophenone?
The molecular weight of 3',4',5'-Trifluoroacetophenone is 174.03 g/mol.
Where can I buy 3',4',5'-Trifluoroacetophenone?
You can request a quote for 3',4',5'-Trifluoroacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4',5'-Trifluoroacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 3',4',5'-Trifluoroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.