Propiophenone, 3'-(trifluoromethyl)
TL;DR: Propiophenone, 3'-(trifluoromethyl) (CAS 53001-71-1) is a chemical compound with molecular formula C10H9F3O and molecular weight 202.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(trifluoromethyl)phenyl]propan-1-one
Also Known As: 3'-(Trifluoromethyl)propiophenone, 1-(3-(Trifluoromethyl)phenyl)propan-1-one, 3-(Trifluoromethyl)propiophenone, 1-[3-(trifluoromethyl)phenyl]propan-1-one, m-Trifluoromethylpropiophenone
| Molecular Formula | C10H9F3O |
|---|---|
| Molecular Weight | 202.06 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.06055 |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 53001-71-1 |
|---|---|
| SMILES | CCC(=O)C1=CC(=CC=C1)C(F)(F)F |
| InChIKey | UBTPNKXHYILGJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propiophenone, 3'-(trifluoromethyl) (CAS 53001-71-1), with molecular formula C10H9F3O and molecular weight 202.06 g/mol. IUPAC: 1-[3-(trifluoromethyl)phenyl]propan-1-one.
Chemical Property Profile of Propiophenone, 3'-(trifluoromethyl)
Property Insights of Propiophenone, 3'-(trifluoromethyl)
The XLogP value of 3.5 indicates that Propiophenone, 3'-(trifluoromethyl) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Propiophenone, 3'-(trifluoromethyl) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propiophenone, 3'-(trifluoromethyl) has 0 hydrogen bond donor(s) and 4 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 Propiophenone, 3'-(trifluoromethyl)?
The CAS number of Propiophenone, 3'-(trifluoromethyl) is 53001-71-1.
What is the molecular formula of Propiophenone, 3'-(trifluoromethyl)?
The molecular formula of Propiophenone, 3'-(trifluoromethyl) is C10H9F3O.
What is the molecular weight of Propiophenone, 3'-(trifluoromethyl)?
The molecular weight of Propiophenone, 3'-(trifluoromethyl) is 202.06 g/mol.
Where can I buy Propiophenone, 3'-(trifluoromethyl)?
You can request a quote for Propiophenone, 3'-(trifluoromethyl) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propiophenone, 3'-(trifluoromethyl)?
Yes, KEHONG BIO provides custom synthesis services for Propiophenone, 3'-(trifluoromethyl) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.