1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one
TL;DR: 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one (CAS 178374-78-2) is a chemical compound with molecular formula C9H8F2O2 and molecular weight 186.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-difluoro-4-hydroxyphenyl)propan-1-one
Also Known As: 3',5'-Difluoro-4'-hydroxypropiophenone, 1-(3,5-difluoro-4-hydroxyphenyl)propan-1-one, 3,5-Difluoro-4-hydroxypropiophenone, 1-(3,5-Difluoro-4-hydroxyphenyl)-1-propanone, 5962AD
| Molecular Formula | C9H8F2O2 |
|---|---|
| Molecular Weight | 186.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.04924 |
| Heavy Atoms | 13 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 178374-78-2 |
|---|---|
| SMILES | CCC(=O)C1=CC(=C(C(=C1)F)O)F |
| InChIKey | PJIDRPUAOWTRGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one (CAS 178374-78-2), with molecular formula C9H8F2O2 and molecular weight 186.05 g/mol. IUPAC: 1-(3,5-difluoro-4-hydroxyphenyl)propan-1-one.
Chemical Property Profile of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one
Property Insights of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one. With a topological polar surface area (TPSA) of 37.3 Ų, 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one has 1 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 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one?
The CAS number of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one is 178374-78-2.
What is the molecular formula of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one?
The molecular formula of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one is C9H8F2O2.
What is the molecular weight of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one?
The molecular weight of 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one is 186.05 g/mol.
Where can I buy 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one?
You can request a quote for 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Difluoro-4-hydroxyphenyl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.