2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione
TL;DR: 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione (CAS 113835-31-7) is a chemical compound with molecular formula C18H12O4 and molecular weight 292.07355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-oxo-3-phenylpropanoyl)indene-1,3-dione
Also Known As: NCIOpen2_005504, 2-(3-oxo-3-phenylpropanoyl)indene-1,3-dione, 2-(3-oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione, 1H-Indene-1,3(2H)-dione,2-(1,3-dioxo-3-phenylpropyl)-
Technical Specifications
| Molecular Formula | C18H12O4 |
| Molecular Weight | 292.07355 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.07355 Da |
| Heavy Atoms | 22 |
| Complexity | 477.0 |
| SMILES | C1=CC=C(C=C1)C(=O)CC(=O)C2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | HUBPJGKAHBSLKO-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione
Property Insights of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione. Following Lipinski's Rule of Five, 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione 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
What is the CAS number of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione?
The CAS number of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione is 113835-31-7.
What is the molecular formula of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione?
The molecular formula of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione is C18H12O4.
What is the molecular weight of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione?
The molecular weight of 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione is 292.07355 g/mol.
Where can I buy 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione?
You can request a quote for 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione?
Yes, CoreyChem provides custom synthesis services for 2-(3-Oxo-3-phenylpropanoyl)-1h-indene-1,3(2h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.