4,7-difluoro-2,3-dihydro-1H-inden-1-one
TL;DR: 4,7-difluoro-2,3-dihydro-1H-inden-1-one (CAS 130408-16-1) is a chemical compound with molecular formula C9H6F2O and molecular weight 168.03867 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,7-difluoro-2,3-dihydroinden-1-one
Also Known As: 4,7-DIFLUOROINDAN-1-ONE, 4,7-Difluoro-1-indanone, 4,7-difluoro-2,3-dihydro-1H-inden-1-one, 1H-Inden-1-one, 4,7-difluoro-2,3-dihydro-, 4,7-difluoro-2,3-dihydroinden-1-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H6F2O |
| Molecular Weight | 168.03867 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.03867 Da |
| Heavy Atoms | 12 |
| Complexity | 205.0 |
| SMILES | C1CC(=O)C2=C(C=CC(=C21)F)F |
| InChIKey | KMWBFTTYYGUTNW-UHFFFAOYSA-N |
Chemical Property Profile of 4,7-difluoro-2,3-dihydro-1H-inden-1-one
Property Insights of 4,7-difluoro-2,3-dihydro-1H-inden-1-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-difluoro-2,3-dihydro-1H-inden-1-one. With a topological polar surface area (TPSA) of 17.1 Ų, 4,7-difluoro-2,3-dihydro-1H-inden-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-difluoro-2,3-dihydro-1H-inden-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,7-difluoro-2,3-dihydro-1H-inden-1-one?
The CAS number of 4,7-difluoro-2,3-dihydro-1H-inden-1-one is 130408-16-1.
What is the molecular formula of 4,7-difluoro-2,3-dihydro-1H-inden-1-one?
The molecular formula of 4,7-difluoro-2,3-dihydro-1H-inden-1-one is C9H6F2O.
What is the molecular weight of 4,7-difluoro-2,3-dihydro-1H-inden-1-one?
The molecular weight of 4,7-difluoro-2,3-dihydro-1H-inden-1-one is 168.03867 g/mol.
Where can I buy 4,7-difluoro-2,3-dihydro-1H-inden-1-one?
You can request a quote for 4,7-difluoro-2,3-dihydro-1H-inden-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,7-difluoro-2,3-dihydro-1H-inden-1-one?
Yes, CoreyChem provides custom synthesis services for 4,7-difluoro-2,3-dihydro-1H-inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.