![2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione structure](/static/products/3141/314-11-4.webp)
2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione (CAS 314-11-4) is a chemical compound with molecular formula C15H8F3NO2 and molecular weight 291.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(trifluoromethyl)phenyl]isoindole-1,3-dione
Also Known As: 2-[2-(trifluoromethyl)phenyl]isoindole-1,3-dione, 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione, N-(2-Trifluormethyl-phenyl)-phthalimid, N-((2-trifluoromethyl)benzene)phthalimide, J3.354.093K
| Molecular Formula | C15H8F3NO2 |
|---|---|
| Molecular Weight | 291.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 291.05072 |
| Heavy Atoms | 21 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 314-11-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC=C3C(F)(F)F |
| InChIKey | TXKWKZXGRPPXJL-UHFFFAOYSA-N |
Product Overview
2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione (CAS 314-11-4), with molecular formula C15H8F3NO2 and molecular weight 291.05 g/mol. IUPAC: 2-[2-(trifluoromethyl)phenyl]isoindole-1,3-dione.
Chemical Property Profile of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
The XLogP value of 3.3 indicates that 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-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 37.4 Ų, 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 5 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-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione is 314-11-4.
What is the molecular formula of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione is C15H8F3NO2.
What is the molecular weight of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione is 291.05 g/mol.
Where can I buy 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-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-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.