IFLab1_000988
TL;DR: IFLab1_000988 (CAS 124003-24-3) is a chemical compound with molecular formula C15H10F3NO3 and molecular weight 309.06128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
Also Known As: IFLab1_000988, BAS 00682473, 2-(2-(trifluoromethyl)phenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, F0270-0007, AE-641/11700148
Technical Specifications
| Molecular Formula | C15H10F3NO3 |
| Molecular Weight | 309.06128 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 309.06128 Da |
| Heavy Atoms | 22 |
| Complexity | 529.0 |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)N2C(=O)C3C4C=CC(C3C2=O)O4 |
| InChIKey | RXJNXCXDFOJRHB-UHFFFAOYSA-N |
Chemical Property Profile of IFLab1_000988
Property Insights of IFLab1_000988
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IFLab1_000988. With a topological polar surface area (TPSA) of 46.6 Ų, IFLab1_000988 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_000988 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of IFLab1_000988?
The CAS number of IFLab1_000988 is 124003-24-3.
What is the molecular formula of IFLab1_000988?
The molecular formula of IFLab1_000988 is C15H10F3NO3.
What is the molecular weight of IFLab1_000988?
The molecular weight of IFLab1_000988 is 309.06128 g/mol.
Where can I buy IFLab1_000988?
You can request a quote for IFLab1_000988 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for IFLab1_000988?
Yes, CoreyChem provides custom synthesis services for IFLab1_000988 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.