2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione
TL;DR: 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione (CAS 56898-22-7) is a chemical compound with molecular formula C17H13FO2 and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-5-fluoro-2-phenylindene-1,3-dione
Also Known As: 1,3-Indandione, 2-ethyl-5-fluoro-2-phenyl-, 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione, 2-ethyl-5-fluoro-2-phenylindene-1,3-dione, RefChem:1063061
| Molecular Formula | C17H13FO2 |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | 3.5527 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.08997 |
| Heavy Atoms | 20 |
| Complexity | 706.1849 |
Chemical Identifiers
| CAS Number | 56898-22-7 |
|---|---|
| SMILES | CCC1(C(=O)C2=C(C1=O)C=C(C=C2)F)C3=CC=CC=C3 |
Product Overview
2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione (CAS 56898-22-7), with molecular formula C17H13FO2 and molecular weight 268.09 g/mol. IUPAC: 2-ethyl-5-fluoro-2-phenylindene-1,3-dione.
Chemical Property Profile of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione
Property Insights of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione
The XLogP value of 3.5527 indicates that 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione has 0 hydrogen bond donor(s) and 2 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 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione?
The CAS number of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione is 56898-22-7.
What is the molecular formula of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione?
The molecular formula of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione is C17H13FO2.
What is the molecular weight of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione?
The molecular weight of 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione is 268.09 g/mol.
Where can I buy 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione?
You can request a quote for 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-5-fluoro-2-phenyl-1H-indene-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.